Natural Product: NPC240722

Natural Product ID:  NPC240722
Common Name:   Scoparone
IUPAC Name:   6,7-dimethoxychromen-2-one
Synonyms:   6,7-Dimethoxycoumarin; 6,7-Dimethylcoumarine; Aesculetin Dimethyl Ether; Scoparone
Molecular Formula:   C11H10O4
Standard InCHIKey:  GUAFOGOEJLSQBT-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C11H10O4/c1-13-9-5-7-3-4-11(12)15-8(7)6-10(9)14-2/h3-6H,1-2H3
Canonical SMILES:  COc1cc2oc(=O)ccc2cc1OC
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO18723 Zanthoxylum avicennae Species Rutaceae Eukaryota stem wood Pakuashan, Changhua County, Taiwan 2006-JUN PMID[18211005]
NPO22915 Stereocaulon azoreum Species Stereocaulaceae Eukaryota UNPD*
NPO3011 Rubia wallichiana Species Rubiaceae Eukaryota HerDing*
NPO29221 Sarcandra glabra Species Chloranthaceae Eukaryota TM-MC*
NPO15248 Eriostemon tomentellus Species Rutaceae Eukaryota UNPD*
NPO12721 Liriodendron tulipifera Species Magnoliaceae Eukaryota TCMID*
NPO16343 Galium album Species Rubiaceae Eukaryota UNPD*
NPO29722 Cyathulae radix NA NA NA TCMSP*
NPO59 Fusarium dimerum Species Nectriaceae Eukaryota UNPD*
NPO30253 Duranta repens Species Verbenaceae Eukaryota HerDing*
NPO8837 Viola mandshurica Species Violaceae Eukaryota TM-MC*
NPO10560 Adenia fruticosa Species Passifloraceae Eukaryota UNPD*
NPO29285 Dendrobium densiflorum Species Orchidaceae Eukaryota TCMID*
NPO17456 Echinochloa esculenta Species Poaceae Eukaryota UNPD*
NPO26439 Folium artemisiae argyi NA NA NA TCMSP*
NPO21030 Monascus kaoliang Species Aspergillaceae Eukaryota UNPD*
NPO30303 Pueraria lobata Species Fabaceae Eukaryota TCM_Taiwan*
NPO25302 Viola philippica Species Violaceae Eukaryota TM-MC*
NPO19215 Ormosia semicastrata Species Fabaceae Eukaryota UNPD*
NPO8698 Zanthoxylum schinifolium Species Rutaceae Eukaryota TCMID*
NPO9496 Gomphostemma crinitum Species Lamiaceae Eukaryota UNPD*
NPO22212 Rhizophora mangle Species Rhizophoraceae Eukaryota UNPD*
NPO29607 Citri sarcodactylis fructus NA NA NA TCMSP*
NPO5168 Radix puerariae Species Lymnaeidae Eukaryota TCMSP*
NPO10750 Bupleurum fruticescens Species Apiaceae Eukaryota TCM_Taiwan*
NPO30303 Pueraria lobata Species Fabaceae Eukaryota HerDing*
NPO21387 Forsythia suspensa Species Oleaceae Eukaryota TCMID*
NPO11400 Aster ptarmicoides Species Asteraceae Eukaryota UNPD*
NPO12100 Citrus sulcata Species Rutaceae Eukaryota TCMID*
NPO11237 Bupleurum salicifolium Species Apiaceae Eukaryota UNPD*
NPO18677 Anagallis arvensis Species Primulaceae Eukaryota UNPD*
NPO10354 Urbanodendron verrucosum Species Lauraceae Eukaryota UNPD*
NPO28985 Radix bupleuri Species Lymnaeidae Eukaryota TCMSP*
NPO10750 Bupleurum fruticescens Species Apiaceae Eukaryota HerDing*
NPO30739 Forsythia suspense Species Oleaceae Eukaryota TCM_Taiwan*
NPO7576.2 Brassica oleracea var. sabauda Varieties Brassicaceae Eukaryota TCMID*
NPO9781 Hyphear tanakae NA NA NA UNPD*
NPO9518 Gardenia jasminoides Species Rubiaceae Eukaryota TCMID*
NPO14974.1 Nostoc commune var. flagelliforme Varieties Nostocaceae Bacteria UNPD*
NPO24547 Xanthoria parietina Species Teloschistaceae Eukaryota UNPD*
NPO8414 Crella incrustans Species Crellidae Eukaryota UNPD*
NPO14204 Herba sarcandrae NA NA NA TCMSP*
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota TCM_Taiwan*
NPO31579 Artemisia capillaries Species Asteraceae Eukaryota TCM_Taiwan*
NPO8707.1 Pueraria montana var. lobata Varieties Fabaceae Eukaryota TCMID*
NPO21413 Armillaria tabescens Species Physalacriaceae Eukaryota UNPD*
NPO11186 Duranta erecta Species Verbenaceae Eukaryota TCMID*
NPO10763 Aralia dasyphylla Species Araliaceae Eukaryota UNPD*
NPO14773 Uncaria perrottetii Species Rubiaceae Eukaryota UNPD*
NPO28636 Vernonia lilacina Species Asteraceae Eukaryota UNPD*
NPO24758 Angelica dahurica Species Apiaceae Eukaryota TM-MC*
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota HerDing*
NPO4271 Dendrobium thyrsiflorum Species Orchidaceae Eukaryota TCM_Taiwan*
NPO26298 Zanthoxylum simulans Species Rutaceae Eukaryota TCMID*
NPO24478 Morinda coreia Species Rubiaceae Eukaryota UNPD*
NPO4970 Torricellia tiliifolia Species Torricelliaceae Eukaryota UNPD*
NPO19561 Garcinia conrauana Species Clusiaceae Eukaryota UNPD*
NPO25802 Agave deserti Species Asparagaceae Eukaryota UNPD*
NPO2582 Plagiomnium undulatum Species Mniaceae Eukaryota UNPD*
NPO26589 Artemisia annua Species Asteraceae Eukaryota TM-MC*
NPO12100 Citrus sulcata Species Rutaceae Eukaryota HerDing*
NPO4271 Dendrobium thyrsiflorum Species Orchidaceae Eukaryota HerDing*
NPO9063 Dendrobium capillipes Species Orchidaceae Eukaryota TCMID*
NPO17552 Senecio flammeus Species Asteraceae Eukaryota UNPD*
NPO26203 Dysidea villosa Species Dysideidae Eukaryota UNPD*
NPO12422 Pinus massoniana Species Pinaceae Eukaryota UNPD*
NPO23441 Schisandra sphaerandra Species Schisandraceae Eukaryota UNPD*
NPO21776 Sesbania grandiflora Species Fabaceae Eukaryota UNPD*
NPO10506 Artemisia apiacea Species Asteraceae Eukaryota TM-MC*
NPO12721 Liriodendron tulipifera Species Magnoliaceae Eukaryota TCM_Taiwan*
NPO5045 Aegle marmelos Species Rutaceae Eukaryota TCM_Taiwan*
NPO24737 Gentiana kuroo Species Gentianaceae Eukaryota TCMID*
NPO6425 Betula davurica Species Betulaceae Eukaryota UNPD*
NPO12874 Sedum cepaea Species Crassulaceae Eukaryota UNPD*
NPO26298 Zanthoxylum simulans Species Rutaceae Eukaryota UNPD*
NPO12674 Colchicum ritchii Species Colchicaceae Eukaryota UNPD*
NPO13854 Prunus serotina Species Rosaceae Eukaryota UNPD*
NPO28276 Artemisia argyi Species Asteraceae Eukaryota TM-MC*
NPO12721 Liriodendron tulipifera Species Magnoliaceae Eukaryota HerDing*
NPO5045 Aegle marmelos Species Rutaceae Eukaryota HerDing*
NPO22524 Ranunculus sceleratus Species Ranunculaceae Eukaryota TCMID*
NPO12437 Kleinia fulgens Species Asteraceae Eukaryota UNPD*
NPO17727 Bothriocline amplifolia Species Asteraceae Eukaryota UNPD*
NPO1267 Acronychia laurifolia Species Rutaceae Eukaryota UNPD*
NPO24248.1 Lactarius deliciosus var. deterrimus Varieties Russulaceae Eukaryota UNPD*
NPO21390 Zanthoxylum integrifoliolum Species Rutaceae Eukaryota PMID[17822293]
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota TM-MC*
NPO14951 Zanthoxylum acanthopodium Species Rutaceae Eukaryota HerDing*
NPO5740 Phellodendron japonicum Species Rutaceae Eukaryota HerDing*
NPO11100 Artemisia capillaris Species Asteraceae Eukaryota TCMID*
NPO13704 Endarachne binghamiae Species Scytosiphonaceae Eukaryota UNPD*
NPO4033 Corydalis gigantea Species Papaveraceae Eukaryota UNPD*
NPO3954 Lanaria lanata Species Lanariaceae Eukaryota UNPD*
NPO8226 Esenbeckia flava Species Rutaceae Eukaryota UNPD*
NPO10492 Artemisia montana Species Asteraceae Eukaryota TM-MC*
NPO15289 Scoparia dulcis Species Plantaginaceae Eukaryota HerDing*
NPO5895 Hibiscus taiwanensis Species Malvaceae Eukaryota HerDing*
NPO9721 Radix moghaniae philippinensis Species Lymnaeidae Eukaryota TCMID*
NPO20787 Achyranthes aspera Species Amaranthaceae Eukaryota UNPD*
NPO3963 Hortonia floribunda Species Monimiaceae Eukaryota UNPD*
NPO21610 Laurencia rigida Species Rhodomelaceae Eukaryota UNPD*
NPO14938 Cybister lateralimarginalis Species Dytiscidae Eukaryota UNPD*
NPO22421 Microtropis japonica Species Celastraceae Eukaryota Stems PMID[18471021]
NPO25094 Artemisia princeps Species Asteraceae Eukaryota TM-MC*
NPO15730.1 Citrus medica var. etrog Varieties Rutaceae Eukaryota HerDing*
NPO638 Aralia fargesii Species Araliaceae Eukaryota TCM_Taiwan*
NPO3011 Rubia wallichiana Species Rubiaceae Eukaryota TCMID*
NPO25259 Schrebera swietenoides Species Oleaceae Eukaryota UNPD*
NPO12176 Streptomyces olivaceus Species Streptomycetaceae Bacteria UNPD*
NPO26789 Tephrosia bidwilli Species Geometridae Eukaryota UNPD*
NPO6708 Cordia multispicata Species Cordiaceae Eukaryota UNPD*
NPO33077 garcinina multiflora Species NA NA fruits PMID[19203247]
NPO4307 Canarium album Species Burseraceae Eukaryota TM-MC*
NPO18265 Citrus tamurana Species Rutaceae Eukaryota HerDing*
NPO638 Aralia fargesii Species Araliaceae Eukaryota HerDing*
NPO18265 Citrus tamurana Species Rutaceae Eukaryota TCMID*
NPO1164 Osteospermum hyoseroides Species Asteraceae Eukaryota UNPD*
NPO16792 Nocardia pseudobrasiliensis Species Nocardiaceae Bacteria UNPD*
NPO22734 Neopringlea integrifolia Species Salicaceae Eukaryota UNPD*
NPO18655 Clerodendranthus spicatus Species Lamiaceae Eukaryota UNPD*
NPO15090 Zanthoxylum leprieurii Species Rutaceae Eukaryota PMID[20413315]
NPO15730 Citrus medica Species Rutaceae Eukaryota TM-MC*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota TCM_Taiwan*
NPO8698 Zanthoxylum schinifolium Species Rutaceae Eukaryota TCM_Taiwan*
NPO5740 Phellodendron japonicum Species Rutaceae Eukaryota TCMID*
NPO25406 Celastrus monospermus Species Celastraceae Eukaryota UNPD*
NPO9018 Millettia rubiginosa Species Fabaceae Eukaryota UNPD*
NPO21835 Buxus rugulosa Species Buxaceae Eukaryota UNPD*
NPO6669 Dysosma delavayi Species Berberidaceae Eukaryota UNPD*
NPO16308 Citrus wilsonii Species Rutaceae Eukaryota TM-MC*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota HerDing*
NPO8698 Zanthoxylum schinifolium Species Rutaceae Eukaryota HerDing*
NPO14951 Zanthoxylum acanthopodium Species Rutaceae Eukaryota TCMID*
NPO25714 Solanum spirale Species Solanaceae Eukaryota UNPD*
NPO14761 Serratula wolffii Species Asteraceae Eukaryota UNPD*
NPO10474 Latrunculia brevis Species Latrunculiidae Eukaryota UNPD*
NPO3017 Artemisia caucasica Species Asteraceae Eukaryota UNPD*
NPO2775 Cyathula officinalis Species Amaranthaceae Eukaryota TM-MC*
NPO19319 Cedrelopsis grevei Species Rutaceae Eukaryota HerDing*
NPO8884 Cuscuta reflexa Species Convolvulaceae Eukaryota HerDing*
NPO9394 Herba artemisiae scopariae NA NA NA TCMID*
NPO15750 Thymus nummularius Species Lamiaceae Eukaryota UNPD*
NPO5933 Drimia fugax Species Hyacinthaceae Eukaryota UNPD*
NPO1117 Hypholoma capnoides Species Strophariaceae Eukaryota UNPD*
NPO7653 Mosla japonica Species Lamiaceae Eukaryota UNPD*
NPO9648 Maharanga bicolor Species Boraginaceae Eukaryota UNPD*
NPO2188 Dendrobium candidum Species Orchidaceae Eukaryota TM-MC*
NPO21387 Forsythia suspensa Species Oleaceae Eukaryota HerDing*
NPO9063 Dendrobium capillipes Species Orchidaceae Eukaryota HerDing*
NPO18039 Herba dendrobii NA NA NA TCMID*
NPO15730.1 Citrus medica var. etrog Varieties Rutaceae Eukaryota TCMID*
NPO1803 Enantia chlorantha Species Pieridae Eukaryota UNPD*
NPO17426 Vismia baccifera Species Hypericaceae Eukaryota UNPD*
NPO226 Bombina variegata Species Bombinatoridae Eukaryota UNPD*
NPO20118 Hormothamnion enteromorphoides NA NA NA UNPD*
NPO11889 Dendrobium chrysanthum Species Orchidaceae Eukaryota TM-MC*
NPO24737 Gentiana kuroo Species Gentianaceae Eukaryota TCM_Taiwan*
NPO9650 Zanthoxylum nitidum Species Rutaceae Eukaryota TCM_Taiwan*
NPO18681 Artemisia scoparia Species Asteraceae Eukaryota TCMID*
NPO24918 Jacobaea cannabifolia Species Asteraceae Eukaryota UNPD*
NPO1911 Ranunculus laetus Species Ranunculaceae Eukaryota UNPD*
NPO26160 Thielavia terricola Species Chaetomiaceae Eukaryota UNPD*
NPO2629 Cystoseira caespitosa Species Sargassaceae Eukaryota UNPD*
NPO20900 Dendrobium chrysotoxum Species Orchidaceae Eukaryota TM-MC*
NPO24737 Gentiana kuroo Species Gentianaceae Eukaryota HerDing*
NPO9650 Zanthoxylum nitidum Species Rutaceae Eukaryota HerDing*
NPO5895 Hibiscus taiwanensis Species Malvaceae Eukaryota TCMID*
NPO991 Dimelaena oreina Species Caliciaceae Eukaryota UNPD*
NPO3110 Selaginella labordei Species Selaginellaceae Eukaryota UNPD*
NPO9366 Rosa transmorrisonensis Species Rosaceae Eukaryota UNPD*
NPO25833 Asclepias subulata Species Apocynaceae Eukaryota UNPD*
NPO25494.1 Dendrobium aurantiacum var. denneanum Varieties Orchidaceae Eukaryota HerDing*
NPO2704 Veratrum sabadilla Species Melanthiaceae Eukaryota UNPD*
NPO22890 Eutrochium purpureum Species Asteraceae Eukaryota UNPD*
NPO10750 Bupleurum fruticescens Species Apiaceae Eukaryota TCMID*
NPO6235 Exobasidium vaccinii Species Exobasidiaceae Eukaryota UNPD*
NPO19014 Palythoa tuberculosa Species Sphenopidae Eukaryota UNPD*
NPO17102 Ocypus olens Species Staphylinidae Eukaryota UNPD*
NPO7142 Corydalis suaveolens Species Papaveraceae Eukaryota UNPD*
NPO26298 Zanthoxylum simulans Species Rutaceae Eukaryota TCM_Taiwan*
NPO4878 Agathosma cedrimontana Species Rutaceae Eukaryota UNPD*
NPO5045 Aegle marmelos Species Rutaceae Eukaryota TCMID*
NPO11482 Monodora brevipes Species Annonaceae Eukaryota UNPD*
NPO22421 Microtropis japonica Species Celastraceae Eukaryota UNPD*
NPO26409 Plakortis simplex Species Plakinidae Eukaryota UNPD*
NPO25201 Aglaia pyramidata Species Meliaceae Eukaryota UNPD*
NPO2291 Saussurea pulchella Species Asteraceae Eukaryota UNPD*
NPO638 Aralia fargesii Species Araliaceae Eukaryota TCMID*
NPO1460 Rubus phoenicolasius Species Rosaceae Eukaryota UNPD*
NPO26849 Parmelia zollingeri Species Parmeliaceae Eukaryota UNPD*
NPO13658 Elsholtzia cristata Species Lamiaceae Eukaryota UNPD*
NPO25122 Conium maculatum Species Apiaceae Eukaryota UNPD*
NPO9324 Notechis scutatus Species Elapidae Eukaryota UNPD*
NPO8884 Cuscuta reflexa Species Convolvulaceae Eukaryota TCMID*
NPO9150 Polypodiodes formosana Species Polypodiaceae Eukaryota UNPD*
NPO3614 Echinopepon bigelovii Species Cucurbitaceae Eukaryota UNPD*
NPO22788 Barnettia kerrii NA NA NA UNPD*
NPO22264 Inula salsoloides Species Asteraceae Eukaryota UNPD*
NPO7991 Lactarius vellereus Species Russulaceae Eukaryota UNPD*
NPO15289 Scoparia dulcis Species Plantaginaceae Eukaryota TCMID*
NPO10719 Centrosema haitense Species Fabaceae Eukaryota UNPD*
NPO3005 Passiflora morifolia Species Passifloraceae Eukaryota UNPD*
NPO20885 Duguetia furfuracea Species Annonaceae Eukaryota UNPD*
NPO3277 Salix alba Species Salicaceae Eukaryota UNPD*
NPO23332 Dendrobium fimbriatum Species Orchidaceae Eukaryota TM-MC*
NPO8500 Eleutherococcus gracilistylus Species Araliaceae Eukaryota UNPD*
NPO9650 Zanthoxylum nitidum Species Rutaceae Eukaryota TCMID*
NPO25358 Senecio gilliesi Species Asteraceae Eukaryota UNPD*
NPO19672 Hosta sieboldiana Species Asparagaceae Eukaryota UNPD*
NPO29542 Lobeliae chinensis herba NA NA NA TCMSP*
NPO21341 Morus macroura Species Moraceae Eukaryota UNPD*
NPO865 Dendrobium loddigesii Species Orchidaceae Eukaryota TM-MC*
NPO20419 Buxus wallichiana Species Buxaceae Eukaryota UNPD*
NPO15730.2 Citrus medica var. sarcodactylis Varieties Rutaceae Eukaryota TCMID*
NPO7327 Aeromonas hydrophila Species Aeromonadaceae Bacteria UNPD*
NPO12659 Hopea brevipetiolaris Species Dipterocarpaceae Eukaryota UNPD*
NPO12446 Folium ilicis cornutae NA NA NA TCMSP*
NPO19133 Brickellia baccharidea Species Asteraceae Eukaryota UNPD*
NPO26298 Zanthoxylum simulans Species Rutaceae Eukaryota HerDing*
NPO3894 Dendrobium nobile Species Orchidaceae Eukaryota TM-MC*
NPO16988 Pseudodistoma novaezelandiae Species Pseudodistomidae Eukaryota UNPD*
NPO26589 Artemisia annua Species Asteraceae Eukaryota TCMID*
NPO26992 Sophora leachiana Species Fabaceae Eukaryota UNPD*
NPO123 Pulsatilliae radix NA NA NA TCMSP*
NPO22272 Raphanus raphanistrum Species Brassicaceae Eukaryota UNPD*
NPO10464 Epipedobates anthonyi Species Dendrobatidae Eukaryota UNPD*
NPO26589 Artemisia annua Species Asteraceae Eukaryota TCM_Taiwan*
NPO851 Eupatorium lindleyanum Species Asteraceae Eukaryota TM-MC*
NPO22670 Phebalium bilobum Species Rutaceae Eukaryota UNPD*
NPO25494.1 Dendrobium aurantiacum var. denneanum Varieties Orchidaceae Eukaryota TCMID*
NPO954 Erythroxylum passerinum Species Erythroxylaceae Eukaryota UNPD*
NPO8624 Artemisiae scopariae herba NA NA NA TCMSP*
NPO14951 Zanthoxylum acanthopodium Species Rutaceae Eukaryota UNPD*
NPO26589 Artemisia annua Species Asteraceae Eukaryota HerDing*
NPO26277 Euphorbia hirta Species Euphorbiaceae Eukaryota TM-MC*
NPO13313 Talipariti tiliaceum Species Malvaceae Eukaryota UNPD*
NPO19319 Cedrelopsis grevei Species Rutaceae Eukaryota TCMID*
NPO20210 Lophozia floerkei Species Scapaniaceae Eukaryota UNPD*
NPO29537 Canarii fructus NA NA NA TCMSP*
NPO26690 Lactarius subpiperatus Species Lactariidae Eukaryota UNPD*
NPO29285 Dendrobium densiflorum Species Orchidaceae Eukaryota HerDing*
NPO14650 Lobelia chinensis Species Campanulaceae Eukaryota TM-MC*
NPO23639 Cynanchum viminale Species Apocynaceae Eukaryota UNPD*
NPO4271 Dendrobium thyrsiflorum Species Orchidaceae Eukaryota TCMID*
NPO21629 Pometia eximia Species Sapindaceae Eukaryota UNPD*
NPO26589 Artemisia annua Species Asteraceae Eukaryota TCMSP*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2740 Cell Line Neutrophils IC50 > 100000 nM 17822293
NPT2 Others Unspecified IC50 > 50000 nM 18211005
NPT2 Others Unspecified IC50 = 42860 nM 18211005
NPT140 Organism Artemia Artemia LC50 = 349 ppm 3379414
NPT2 Others Unspecified ED50 = 61 ug/ml 3379414
NPT2 Others Unspecified IC50 = 41400 nM 18817445
NPT2 Others Unspecified IC50 > 50000 nM 18817445
NPT88 Organism Mycobacterium tuberculosis Mycobacterium tuberculosis MIC = 388000 nM 18471021
NPT2 Others Unspecified IC50 > 30000 nM 19203247
NPT2 Others Unspecified IC50 = 8.25 ug/ml 19128011
NPT2 Others Unspecified Inhibition = 43.1 % 19128011
NPT81 Cell Line A549 Homo sapiens IC50 > 100000 nM 20413315
NPT579 Cell Line DLD-1 Homo sapiens IC50 > 100000 nM 20413315
NPT2 Others Unspecified IC50 > 100000 nM 20413315
NPT740 Individual Protein Beta-secretase 1 Homo sapiens IC50 > 500000 nM 22222157
NPT740 Individual Protein Beta-secretase 1 Homo sapiens Inhibition = 6.2 % 22222157
NPT466 Cell Line U-937 Homo sapiens CC50 = 1289000 nM 22925447
NPT466 Cell Line U-937 Homo sapiens IC50 = 589900 nM 22925447
NPT2 Others Unspecified EC50 = 80000 nM 24681028
NPT2 Others Unspecified IC50 = 54400 nM 26711890
NPT2 Others Unspecified IC50 = 11400 nM 26711890
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC > 1 ug/ml 26711890
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 1 ug/ml 26711890
NPT19 Organism Escherichia coli Escherichia coli MIC > 1 ug/ml 26711890
NPT2526 Organism Rhizomucor miehei Rhizomucor miehei MIC > 1 ug/ml 26711890
NPT20 Organism Candida albicans Candida albicans MIC > 1 ug/ml 26711890
NPT2 Others Unspecified MIC > 1 ug/ml 26711890
NPT2527 Organism Pythium ultimum Pythium ultimum MIC > 1 ug/ml 26711890
NPT529 Organism Rhizoctonia solani Rhizoctonia solani MIC > 1 ug/ml 26711890

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC240722 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
1.0 High Similarity NPC244799
0.9919 High Similarity NPC123127
0.9919 High Similarity NPC27239
0.984 High Similarity NPC137669
0.9762 High Similarity NPC241341
0.9762 High Similarity NPC233018
0.9762 High Similarity NPC36437
0.9685 High Similarity NPC309953
0.9535 High Similarity NPC167517
0.9528 High Similarity NPC319969
0.9524 High Similarity NPC19242
0.9462 High Similarity NPC139548
0.9462 High Similarity NPC148835
0.9462 High Similarity NPC20796
0.9462 High Similarity NPC20511
0.9462 High Similarity NPC52086
0.9462 High Similarity NPC95162
0.9462 High Similarity NPC76336
0.9457 High Similarity NPC240915
0.9457 High Similarity NPC234865
0.9389 High Similarity NPC164148
0.9389 High Similarity NPC13067
0.9389 High Similarity NPC43500
0.9389 High Similarity NPC270256
0.9385 High Similarity NPC126682
0.9385 High Similarity NPC82271
0.9385 High Similarity NPC286843
0.938 High Similarity NPC7163
0.9308 High Similarity NPC73071
0.9302 High Similarity NPC472522
0.9248 High Similarity NPC300611
0.9231 High Similarity NPC474600
0.9231 High Similarity NPC92830
0.9225 High Similarity NPC123954
0.9213 High Similarity NPC474616
0.9154 High Similarity NPC26673
0.9134 High Similarity NPC474670
0.9134 High Similarity NPC194841
0.9111 High Similarity NPC138212
0.9084 High Similarity NPC147030
0.9077 High Similarity NPC137949
0.9062 High Similarity NPC474651
0.9062 High Similarity NPC474623
0.9055 High Similarity NPC127604
0.904 High Similarity NPC194626
0.9024 High Similarity NPC298796
0.9015 High Similarity NPC472521
0.9008 High Similarity NPC277021
0.9 High Similarity NPC73738
0.8984 High Similarity NPC474821
0.8971 High Similarity NPC7439
0.8971 High Similarity NPC34245
0.8971 High Similarity NPC256555
0.8971 High Similarity NPC236419
0.8971 High Similarity NPC91492
0.8971 High Similarity NPC110067
0.8952 High Similarity NPC222175
0.8943 High Similarity NPC152306
0.8943 High Similarity NPC265547
0.8923 High Similarity NPC476399
0.8913 High Similarity NPC205361
0.8906 High Similarity NPC474632
0.8889 High Similarity NPC288238
0.888 High Similarity NPC163200
0.8871 High Similarity NPC281356
0.8849 High Similarity NPC15577
0.8849 High Similarity NPC231149
0.8841 High Similarity NPC476450
0.8832 High Similarity NPC230157
0.881 High Similarity NPC310373
0.879 High Similarity NPC96705
0.8788 High Similarity NPC245120
0.8788 High Similarity NPC5423
0.8786 High Similarity NPC139839
0.8786 High Similarity NPC96294
0.878 High Similarity NPC128633
0.8779 High Similarity NPC474617
0.8769 High Similarity NPC474636
0.8769 High Similarity NPC210674
0.8741 High Similarity NPC474530
0.8741 High Similarity NPC474521
0.8741 High Similarity NPC38874
0.8741 High Similarity NPC474540
0.8731 High Similarity NPC224941
0.8731 High Similarity NPC311430
0.873 High Similarity NPC235190
0.873 High Similarity NPC180006
0.8723 High Similarity NPC176903
0.8723 High Similarity NPC30688
0.872 High Similarity NPC308217
0.871 High Similarity NPC304208
0.871 High Similarity NPC52464
0.8686 High Similarity NPC472520
0.8686 High Similarity NPC279851
0.8682 High Similarity NPC27352
0.8672 High Similarity NPC108545
0.8672 High Similarity NPC273772
0.8672 High Similarity NPC472518
0.8672 High Similarity NPC109675
0.8662 High Similarity NPC21184
0.8662 High Similarity NPC120426
0.8662 High Similarity NPC205727
0.8662 High Similarity NPC294522
0.8662 High Similarity NPC114740
0.8661 High Similarity NPC144418
0.8657 High Similarity NPC111635
0.8652 High Similarity NPC48366
0.8636 High Similarity NPC307042
0.8636 High Similarity NPC79184
0.8633 High Similarity NPC185127
0.8633 High Similarity NPC471763
0.8626 High Similarity NPC199204
0.8618 High Similarity NPC87563
0.8615 High Similarity NPC101894
0.8605 High Similarity NPC73413
0.8605 High Similarity NPC27671
0.8605 High Similarity NPC201667
0.8603 High Similarity NPC476171
0.8603 High Similarity NPC474886
0.8601 High Similarity NPC213197
0.8594 High Similarity NPC96286
0.8594 High Similarity NPC248429
0.8592 High Similarity NPC212670
0.8592 High Similarity NPC206264
0.8592 High Similarity NPC313334
0.8583 High Similarity NPC267064
0.8582 High Similarity NPC476347
0.8582 High Similarity NPC474810
0.8582 High Similarity NPC167111
0.8582 High Similarity NPC318400
0.8582 High Similarity NPC133956
0.8582 High Similarity NPC296624
0.8582 High Similarity NPC207002
0.8582 High Similarity NPC178129
0.8582 High Similarity NPC471910
0.8561 High Similarity NPC6568
0.8561 High Similarity NPC153547
0.8561 High Similarity NPC168710
0.8542 High Similarity NPC264875
0.8542 High Similarity NPC163598
0.8542 High Similarity NPC120774
0.8538 High Similarity NPC471827
0.8538 High Similarity NPC471828
0.8538 High Similarity NPC300326
0.8538 High Similarity NPC58279
0.8527 High Similarity NPC154176
0.8527 High Similarity NPC173350
0.8527 High Similarity NPC315807
0.8527 High Similarity NPC290605
0.8521 High Similarity NPC476348
0.8521 High Similarity NPC187398
0.8519 High Similarity NPC55149
0.8519 High Similarity NPC100986
0.8519 High Similarity NPC195343
0.8519 High Similarity NPC47163
0.8519 High Similarity NPC287182
0.8519 High Similarity NPC267412
0.8519 High Similarity NPC84894
0.8519 High Similarity NPC319859
0.8519 High Similarity NPC18804
0.8519 High Similarity NPC166672
0.8519 High Similarity NPC260265
0.8519 High Similarity NPC198381
0.8519 High Similarity NPC164269
0.8519 High Similarity NPC127888
0.8519 High Similarity NPC307412
0.8519 High Similarity NPC74655
0.8507 High Similarity NPC14248
0.8496 Intermediate Similarity NPC80170
0.8492 Intermediate Similarity NPC124916
0.8489 Intermediate Similarity NPC469564
0.8485 Intermediate Similarity NPC109275
0.8485 Intermediate Similarity NPC185066
0.8473 Intermediate Similarity NPC234109
0.8473 Intermediate Similarity NPC188327
0.8473 Intermediate Similarity NPC471826
0.8473 Intermediate Similarity NPC244364
0.8462 Intermediate Similarity NPC283170
0.8462 Intermediate Similarity NPC191768
0.8462 Intermediate Similarity NPC111347
0.8462 Intermediate Similarity NPC92869
0.8456 Intermediate Similarity NPC472424
0.8456 Intermediate Similarity NPC471625
0.8456 Intermediate Similarity NPC469675
0.8456 Intermediate Similarity NPC33986
0.8456 Intermediate Similarity NPC281241
0.8456 Intermediate Similarity NPC471909
0.8456 Intermediate Similarity NPC86892
0.8451 Intermediate Similarity NPC41844
0.8451 Intermediate Similarity NPC52740
0.845 Intermediate Similarity NPC270326
0.845 Intermediate Similarity NPC257188
0.845 Intermediate Similarity NPC211231
0.845 Intermediate Similarity NPC13007
0.8444 Intermediate Similarity NPC222036
0.8444 Intermediate Similarity NPC7526
0.8438 Intermediate Similarity NPC319378
0.8438 Intermediate Similarity NPC302107
0.8438 Intermediate Similarity NPC472596
0.8433 Intermediate Similarity NPC142530

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC240722 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.8592 High Similarity NPD1653 Approved
0.8372 Intermediate Similarity NPD422 Phase 1
0.8194 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.8074 Intermediate Similarity NPD1008 Clinical (unspecified phase)
0.7941 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7914 Intermediate Similarity NPD447 Suspended
0.7902 Intermediate Similarity NPD1652 Phase 2
0.7886 Intermediate Similarity NPD9697 Approved
0.7881 Intermediate Similarity NPD3817 Phase 2
0.7868 Intermediate Similarity NPD3018 Phase 2
0.7868 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7843 Intermediate Similarity NPD919 Approved
0.7842 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7842 Intermediate Similarity NPD1613 Approved
0.7826 Intermediate Similarity NPD1296 Phase 2
0.7815 Intermediate Similarity NPD2801 Approved
0.7761 Intermediate Similarity NPD2981 Phase 2
0.776 Intermediate Similarity NPD1358 Approved
0.7744 Intermediate Similarity NPD3496 Discontinued
0.771 Intermediate Similarity NPD5536 Phase 2
0.7704 Intermediate Similarity NPD2983 Phase 2
0.7704 Intermediate Similarity NPD2982 Phase 2
0.7673 Intermediate Similarity NPD5844 Phase 1
0.7628 Intermediate Similarity NPD1247 Approved
0.7626 Intermediate Similarity NPD3027 Phase 3
0.7622 Intermediate Similarity NPD3748 Approved
0.7593 Intermediate Similarity NPD7549 Discontinued
0.7571 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7568 Intermediate Similarity NPD1511 Approved
0.7564 Intermediate Similarity NPD5494 Approved
0.7556 Intermediate Similarity NPD1611 Approved
0.7535 Intermediate Similarity NPD5124 Phase 1
0.7535 Intermediate Similarity NPD230 Phase 1
0.7535 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7535 Intermediate Similarity NPD1933 Approved
0.7533 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7519 Intermediate Similarity NPD1548 Phase 1
0.7516 Intermediate Similarity NPD1934 Approved
0.7484 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD1465 Phase 2
0.7467 Intermediate Similarity NPD1512 Approved
0.7467 Intermediate Similarity NPD7314 Clinical (unspecified phase)
0.7466 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.745 Intermediate Similarity NPD6799 Approved
0.7426 Intermediate Similarity NPD3705 Approved
0.7419 Intermediate Similarity NPD5402 Approved
0.7417 Intermediate Similarity NPD920 Approved
0.7415 Intermediate Similarity NPD1243 Approved
0.7413 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7405 Intermediate Similarity NPD5283 Phase 1
0.7402 Intermediate Similarity NPD3134 Approved
0.7391 Intermediate Similarity NPD3225 Approved
0.7372 Intermediate Similarity NPD3882 Suspended
0.7365 Intermediate Similarity NPD3750 Approved
0.7342 Intermediate Similarity NPD5677 Discontinued
0.7333 Intermediate Similarity NPD5691 Approved
0.7329 Intermediate Similarity NPD1551 Phase 2
0.7329 Intermediate Similarity NPD2796 Approved
0.7329 Intermediate Similarity NPD3539 Phase 1
0.7328 Intermediate Similarity NPD5535 Approved
0.7319 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD5353 Approved
0.7299 Intermediate Similarity NPD1610 Phase 2
0.7286 Intermediate Similarity NPD1019 Discontinued
0.7285 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7279 Intermediate Similarity NPD3540 Phase 1
0.7279 Intermediate Similarity NPD1778 Approved
0.7273 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7252 Intermediate Similarity NPD228 Approved
0.7248 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7246 Intermediate Similarity NPD9717 Approved
0.7244 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD5297 Approved
0.7219 Intermediate Similarity NPD4357 Discontinued
0.7214 Intermediate Similarity NPD3266 Approved
0.7214 Intermediate Similarity NPD3267 Approved
0.7211 Intermediate Similarity NPD2935 Discontinued
0.7188 Intermediate Similarity NPD7199 Phase 2
0.7183 Intermediate Similarity NPD6832 Phase 2
0.7183 Intermediate Similarity NPD4908 Phase 1
0.7178 Intermediate Similarity NPD3818 Discontinued
0.7174 Intermediate Similarity NPD1091 Approved
0.7171 Intermediate Similarity NPD5401 Approved
0.7161 Intermediate Similarity NPD6599 Discontinued
0.7153 Intermediate Similarity NPD4626 Approved
0.7153 Intermediate Similarity NPD17 Approved
0.7143 Intermediate Similarity NPD1241 Discontinued
0.7143 Intermediate Similarity NPD6232 Discontinued
0.7134 Intermediate Similarity NPD7054 Approved
0.7134 Intermediate Similarity NPD7819 Suspended
0.7134 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7123 Intermediate Similarity NPD2653 Approved
0.7105 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7103 Intermediate Similarity NPD4307 Phase 2
0.7103 Intermediate Similarity NPD4060 Phase 1
0.7099 Intermediate Similarity NPD3926 Phase 2
0.7099 Intermediate Similarity NPD5242 Approved
0.7099 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7092 Intermediate Similarity NPD2797 Approved
0.7092 Intermediate Similarity NPD1203 Approved
0.7091 Intermediate Similarity NPD7472 Approved
0.7086 Intermediate Similarity NPD5307 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD411 Approved
0.7083 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.708 Intermediate Similarity NPD5585 Approved
0.7078 Intermediate Similarity NPD5403 Approved
0.7077 Intermediate Similarity NPD290 Approved
0.7071 Intermediate Similarity NPD4749 Approved
0.707 Intermediate Similarity NPD6801 Discontinued
0.707 Intermediate Similarity NPD37 Approved
0.7059 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD4340 Discontinued
0.7055 Intermediate Similarity NPD6166 Phase 2
0.7055 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7055 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7047 Intermediate Similarity NPD7266 Discontinued
0.7044 Intermediate Similarity NPD4967 Phase 2
0.7044 Intermediate Similarity NPD4965 Approved
0.7044 Intermediate Similarity NPD4966 Approved
0.7037 Intermediate Similarity NPD6671 Approved
0.7034 Intermediate Similarity NPD6233 Phase 2
0.7032 Intermediate Similarity NPD3686 Approved
0.7032 Intermediate Similarity NPD3687 Approved
0.7027 Intermediate Similarity NPD1510 Phase 2
0.702 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7012 Intermediate Similarity NPD7473 Discontinued
0.7006 Intermediate Similarity NPD5089 Approved
0.7006 Intermediate Similarity NPD6385 Approved
0.7006 Intermediate Similarity NPD5090 Approved
0.7006 Intermediate Similarity NPD6386 Approved
0.7 Intermediate Similarity NPD1549 Phase 2
0.7 Intermediate Similarity NPD1608 Approved
0.7 Intermediate Similarity NPD7075 Discontinued
0.6993 Remote Similarity NPD2237 Approved
0.6993 Remote Similarity NPD2861 Phase 2
0.6988 Remote Similarity NPD7074 Phase 3
0.6986 Remote Similarity NPD1240 Approved
0.6975 Remote Similarity NPD8127 Discontinued
0.6974 Remote Similarity NPD6190 Approved
0.6974 Remote Similarity NPD2219 Phase 1
0.6971 Remote Similarity NPD6621 Clinical (unspecified phase)
0.6966 Remote Similarity NPD3268 Approved
0.6964 Remote Similarity NPD7808 Phase 3
0.6957 Remote Similarity NPD6234 Discontinued
0.6957 Remote Similarity NPD9268 Approved
0.6948 Remote Similarity NPD3146 Approved
0.6948 Remote Similarity NPD3688 Clinical (unspecified phase)
0.6946 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6946 Remote Similarity NPD6797 Phase 2
0.6943 Remote Similarity NPD4675 Approved
0.6943 Remote Similarity NPD4678 Approved
0.6933 Remote Similarity NPD1375 Discontinued
0.6933 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6933 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6929 Remote Similarity NPD1535 Discovery
0.6918 Remote Similarity NPD4585 Approved
0.6913 Remote Similarity NPD4308 Phase 3
0.6908 Remote Similarity NPD4628 Phase 3
0.6908 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6908 Remote Similarity NPD4110 Phase 3
0.6905 Remote Similarity NPD7251 Discontinued
0.6903 Remote Similarity NPD3647 Clinical (unspecified phase)
0.6899 Remote Similarity NPD7411 Suspended
0.6897 Remote Similarity NPD7095 Approved
0.6897 Remote Similarity NPD4625 Phase 3
0.6894 Remote Similarity NPD2684 Approved
0.6894 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6892 Remote Similarity NPD1607 Approved
0.6883 Remote Similarity NPD7837 Clinical (unspecified phase)
0.6879 Remote Similarity NPD6055 Clinical (unspecified phase)
0.6879 Remote Similarity NPD1481 Phase 2
0.6879 Remote Similarity NPD8158 Clinical (unspecified phase)
0.6879 Remote Similarity NPD9269 Phase 2
0.6875 Remote Similarity NPD9494 Approved
0.6871 Remote Similarity NPD1558 Phase 1
0.687 Remote Similarity NPD968 Approved
0.6849 Remote Similarity NPD6798 Discontinued
0.6849 Remote Similarity NPD6410 Clinical (unspecified phase)
0.6846 Remote Similarity NPD6111 Discontinued
0.6842 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6839 Remote Similarity NPD1424 Approved
0.6835 Remote Similarity NPD4380 Phase 2
0.6835 Remote Similarity NPD1357 Approved
0.6832 Remote Similarity NPD7768 Phase 2
0.6831 Remote Similarity NPD4359 Approved
0.6828 Remote Similarity NPD5752 Clinical (unspecified phase)
0.6824 Remote Similarity NPD6355 Discontinued
0.6821 Remote Similarity NPD5763 Approved
0.6821 Remote Similarity NPD5762 Approved
0.6818 Remote Similarity NPD7124 Phase 2
0.6815 Remote Similarity NPD7843 Approved
0.6812 Remote Similarity NPD1408 Clinical (unspecified phase)
0.6812 Remote Similarity NPD7644 Approved
0.6803 Remote Similarity NPD1726 Clinical (unspecified phase)
0.679 Remote Similarity NPD6971 Discontinued
0.6788 Remote Similarity NPD7157 Approved
0.6783 Remote Similarity NPD2922 Phase 1
0.6783 Remote Similarity NPD8651 Approved
0.6776 Remote Similarity NPD2424 Discontinued

Structure

External Identifiers

PubChem CID   8417
ChEMBL   CHEMBL325864
ZINC  

Physicochemical Properties

Molecular Weight:  206.06
ALogP:  0.1664
MLogP:  2.23
XLogP:  1.607
# Rotatable Bonds:  4
Polar Surface Area:  44.76
# H-Bond Aceptor:  1
# H-Bond Donor:  0
# Rings:  2
# Heavy Atoms:  15

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Biological Activities  
Similar NPs/Drugs