Natural Product: NPC184391

Natural Product ID:  NPC184391
Common Name:   Chlorantene E
IUPAC Name:  
Synonyms:   Chlorantene E
Molecular Formula:   C15H16O3
Standard InCHIKey:  KELZYRMOEAISJM-UXBLZVDNSA-N
Standard InCHI:  InChI=1S/C15H16O3/c1-9-5-4-6-10(2)14(17)15-13(12(16)7-9)11(3)8-18-15/h6,8H,1,4-5,7H2,2-3H3/b10-6+
Canonical SMILES:  C=C1CC/C=C(C)/C(=O)c2c(C(=O)C1)c(C)co2
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
NPO21178 Chloranthus serratus Species Chloranthaceae Eukaryota PMID[19053511]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT452 Organism Helicobacter pylori SS1 Helicobacter pylori SS1 MIC = 25 ug/ml 2579237

  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 NPC184391 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
0.8992 High Similarity NPC200718
0.8739 High Similarity NPC22678
0.8722 High Similarity NPC177262
0.8538 High Similarity NPC45947
0.8537 High Similarity NPC227660
0.8516 High Similarity NPC216810
0.8455 Intermediate Similarity NPC45536
0.8226 Intermediate Similarity NPC205523
0.8129 Intermediate Similarity NPC248795
0.8125 Intermediate Similarity NPC79557
0.8116 Intermediate Similarity NPC265181
0.8102 Intermediate Similarity NPC286130
0.8095 Intermediate Similarity NPC312525
0.8095 Intermediate Similarity NPC217180
0.8077 Intermediate Similarity NPC118853
0.806 Intermediate Similarity NPC136340
0.8058 Intermediate Similarity NPC18904
0.8058 Intermediate Similarity NPC473681
0.8058 Intermediate Similarity NPC61157
0.8058 Intermediate Similarity NPC218204
0.8028 Intermediate Similarity NPC195920
0.8016 Intermediate Similarity NPC59035
0.8016 Intermediate Similarity NPC79202
0.7984 Intermediate Similarity NPC97566
0.7972 Intermediate Similarity NPC475864
0.7958 Intermediate Similarity NPC117674
0.7931 Intermediate Similarity NPC192069
0.7931 Intermediate Similarity NPC475904
0.7931 Intermediate Similarity NPC474270
0.7917 Intermediate Similarity NPC281398
0.7905 Intermediate Similarity NPC88958
0.7902 Intermediate Similarity NPC27798
0.7902 Intermediate Similarity NPC93241
0.7883 Intermediate Similarity NPC106247
0.7879 Intermediate Similarity NPC473885
0.7879 Intermediate Similarity NPC471074
0.7868 Intermediate Similarity NPC471817
0.7862 Intermediate Similarity NPC474255
0.7862 Intermediate Similarity NPC474220
0.7862 Intermediate Similarity NPC471618
0.7857 Intermediate Similarity NPC474615
0.7847 Intermediate Similarity NPC233763
0.7842 Intermediate Similarity NPC42400
0.7829 Intermediate Similarity NPC137710
0.7829 Intermediate Similarity NPC67345
0.7829 Intermediate Similarity NPC244862
0.7826 Intermediate Similarity NPC159786
0.781 Intermediate Similarity NPC470740
0.7801 Intermediate Similarity NPC282973
0.7795 Intermediate Similarity NPC28054
0.7793 Intermediate Similarity NPC224418
0.7787 Intermediate Similarity NPC42471
0.7786 Intermediate Similarity NPC323118
0.7778 Intermediate Similarity NPC245522
0.7778 Intermediate Similarity NPC37488
0.7778 Intermediate Similarity NPC114513
0.7762 Intermediate Similarity NPC110305
0.7761 Intermediate Similarity NPC141059
0.7737 Intermediate Similarity NPC473982
0.7724 Intermediate Similarity NPC219969
0.7724 Intermediate Similarity NPC140688
0.7714 Intermediate Similarity NPC473268
0.771 Intermediate Similarity NPC115859
0.7704 Intermediate Similarity NPC329707
0.7703 Intermediate Similarity NPC144010
0.7692 Intermediate Similarity NPC473152
0.7687 Intermediate Similarity NPC83301
0.7671 Intermediate Similarity NPC474317
0.7669 Intermediate Similarity NPC188377
0.7669 Intermediate Similarity NPC65735
0.7669 Intermediate Similarity NPC178382
0.7667 Intermediate Similarity NPC472786
0.7664 Intermediate Similarity NPC477645
0.766 Intermediate Similarity NPC472376
0.7652 Intermediate Similarity NPC174915
0.7652 Intermediate Similarity NPC270807
0.7651 Intermediate Similarity NPC474378
0.7651 Intermediate Similarity NPC474219
0.7651 Intermediate Similarity NPC471613
0.7651 Intermediate Similarity NPC145830
0.7647 Intermediate Similarity NPC50583
0.7647 Intermediate Similarity NPC59502
0.7643 Intermediate Similarity NPC217914
0.7642 Intermediate Similarity NPC298087
0.7619 Intermediate Similarity NPC252208
0.7615 Intermediate Similarity NPC243704
0.7615 Intermediate Similarity NPC206007
0.7615 Intermediate Similarity NPC21831
0.7615 Intermediate Similarity NPC187547
0.7603 Intermediate Similarity NPC478166
0.7568 Intermediate Similarity NPC280025
0.7557 Intermediate Similarity NPC473969
0.7556 Intermediate Similarity NPC52035
0.7554 Intermediate Similarity NPC474425
0.7554 Intermediate Similarity NPC474426
0.7554 Intermediate Similarity NPC474407
0.7554 Intermediate Similarity NPC293253
0.7551 Intermediate Similarity NPC250331
0.755 Intermediate Similarity NPC75310
0.755 Intermediate Similarity NPC179170
0.7537 Intermediate Similarity NPC243269
0.7536 Intermediate Similarity NPC475092
0.7519 Intermediate Similarity NPC150895
0.7518 Intermediate Similarity NPC146872
0.7517 Intermediate Similarity NPC254198
0.7517 Intermediate Similarity NPC226578
0.75 Intermediate Similarity NPC53953
0.7483 Intermediate Similarity NPC474261
0.7483 Intermediate Similarity NPC62799
0.7483 Intermediate Similarity NPC107571
0.7483 Intermediate Similarity NPC233707
0.7481 Intermediate Similarity NPC474829
0.7468 Intermediate Similarity NPC333139
0.7467 Intermediate Similarity NPC472406
0.7467 Intermediate Similarity NPC472787
0.7466 Intermediate Similarity NPC84479
0.7466 Intermediate Similarity NPC218712
0.7466 Intermediate Similarity NPC261733
0.7466 Intermediate Similarity NPC267004
0.7466 Intermediate Similarity NPC307346
0.7465 Intermediate Similarity NPC232996
0.7462 Intermediate Similarity NPC476031
0.7462 Intermediate Similarity NPC476014
0.7459 Intermediate Similarity NPC217226
0.7451 Intermediate Similarity NPC221992
0.7447 Intermediate Similarity NPC209858
0.7444 Intermediate Similarity NPC1848
0.7442 Intermediate Similarity NPC292036
0.7442 Intermediate Similarity NPC252004
0.7434 Intermediate Similarity NPC41719
0.7434 Intermediate Similarity NPC290927
0.7432 Intermediate Similarity NPC190572
0.7431 Intermediate Similarity NPC148374
0.7426 Intermediate Similarity NPC470858
0.7417 Intermediate Similarity NPC475777
0.7413 Intermediate Similarity NPC29638
0.7413 Intermediate Similarity NPC236532
0.7407 Intermediate Similarity NPC11799
0.7407 Intermediate Similarity NPC141252
0.7405 Intermediate Similarity NPC472895
0.7405 Intermediate Similarity NPC131801
0.7405 Intermediate Similarity NPC144745
0.7405 Intermediate Similarity NPC208906
0.7403 Intermediate Similarity NPC10051
0.7403 Intermediate Similarity NPC294300
0.7403 Intermediate Similarity NPC473282
0.7403 Intermediate Similarity NPC104380
0.7403 Intermediate Similarity NPC299094
0.7403 Intermediate Similarity NPC476404
0.7403 Intermediate Similarity NPC217602
0.7403 Intermediate Similarity NPC317900
0.7397 Intermediate Similarity NPC22248
0.7394 Intermediate Similarity NPC303217
0.7391 Intermediate Similarity NPC208389
0.7388 Intermediate Similarity NPC314329
0.7388 Intermediate Similarity NPC263870
0.7385 Intermediate Similarity NPC11821
0.7383 Intermediate Similarity NPC198427
0.7379 Intermediate Similarity NPC477537
0.7377 Intermediate Similarity NPC156768
0.7376 Intermediate Similarity NPC477536
0.7372 Intermediate Similarity NPC474830
0.7372 Intermediate Similarity NPC319140
0.7372 Intermediate Similarity NPC95567
0.7372 Intermediate Similarity NPC237868
0.7372 Intermediate Similarity NPC246392
0.7368 Intermediate Similarity NPC246214
0.7365 Intermediate Similarity NPC262198
0.7365 Intermediate Similarity NPC104924
0.7357 Intermediate Similarity NPC324488
0.7344 Intermediate Similarity NPC105249
0.7343 Intermediate Similarity NPC307401
0.7338 Intermediate Similarity NPC21460
0.7338 Intermediate Similarity NPC81405
0.7328 Intermediate Similarity NPC76844
0.7328 Intermediate Similarity NPC474987
0.7324 Intermediate Similarity NPC247743
0.7324 Intermediate Similarity NPC265793
0.7324 Intermediate Similarity NPC324117
0.732 Intermediate Similarity NPC472785
0.7319 Intermediate Similarity NPC26532
0.7315 Intermediate Similarity NPC471346
0.731 Intermediate Similarity NPC201370
0.731 Intermediate Similarity NPC473983
0.7308 Intermediate Similarity NPC472781
0.7308 Intermediate Similarity NPC472782
0.7303 Intermediate Similarity NPC156244
0.7299 Intermediate Similarity NPC224657
0.7297 Intermediate Similarity NPC469385
0.7293 Intermediate Similarity NPC35744
0.7292 Intermediate Similarity NPC301341
0.7292 Intermediate Similarity NPC477534
0.7292 Intermediate Similarity NPC284184
0.729 Intermediate Similarity NPC140952
0.7285 Intermediate Similarity NPC46551
0.7279 Intermediate Similarity NPC64568
0.7279 Intermediate Similarity NPC27220
0.7279 Intermediate Similarity NPC205071
0.7279 Intermediate Similarity NPC267632
0.7267 Intermediate Similarity NPC19747

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC184391 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
0.8116 Intermediate Similarity NPD1471 Phase 3
0.7483 Intermediate Similarity NPD2344 Approved
0.7468 Intermediate Similarity NPD5537 Clinical (unspecified phase)
0.7388 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7361 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7279 Intermediate Similarity NPD2309 Approved
0.7231 Intermediate Similarity NPD1241 Discontinued
0.7152 Intermediate Similarity NPD1247 Approved
0.7143 Intermediate Similarity NPD6280 Approved
0.7143 Intermediate Similarity NPD9092 Discovery
0.7143 Intermediate Similarity NPD6279 Approved
0.708 Intermediate Similarity NPD3972 Approved
0.705 Intermediate Similarity NPD1049 Clinical (unspecified phase)
0.7039 Intermediate Similarity NPD920 Approved
0.7021 Intermediate Similarity NPD6832 Phase 2
0.702 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD6808 Phase 2
0.7 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.6978 Remote Similarity NPD1876 Approved
0.6939 Remote Similarity NPD2796 Approved
0.6918 Remote Similarity NPD919 Approved
0.6913 Remote Similarity NPD1243 Approved
0.6879 Remote Similarity NPD2798 Approved
0.6879 Remote Similarity NPD1019 Discontinued
0.6871 Remote Similarity NPD2799 Discontinued
0.687 Remote Similarity NPD2181 Clinical (unspecified phase)
0.6852 Remote Similarity NPD3926 Phase 2
0.6842 Remote Similarity NPD6799 Approved
0.6835 Remote Similarity NPD9717 Approved
0.6829 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6806 Remote Similarity NPD2313 Discontinued
0.6795 Remote Similarity NPD6599 Discontinued
0.679 Remote Similarity NPD5668 Clinical (unspecified phase)
0.673 Remote Similarity NPD2296 Approved
0.6712 Remote Similarity NPD3142 Approved
0.6712 Remote Similarity NPD3140 Approved
0.6711 Remote Similarity NPD3887 Approved
0.6692 Remote Similarity NPD1609 Clinical (unspecified phase)
0.669 Remote Similarity NPD3267 Approved
0.669 Remote Similarity NPD3266 Approved
0.6689 Remote Similarity NPD2800 Approved
0.6689 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6687 Remote Similarity NPD3882 Suspended
0.6667 Remote Similarity NPD2346 Discontinued
0.6624 Remote Similarity NPD3226 Approved
0.6623 Remote Similarity NPD1549 Phase 2
0.6599 Remote Similarity NPD1240 Approved
0.6591 Remote Similarity NPD2182 Approved
0.6581 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6575 Remote Similarity NPD3268 Approved
0.6573 Remote Similarity NPD1203 Approved
0.657 Remote Similarity NPD8434 Phase 2
0.6562 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6556 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6556 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6556 Remote Similarity NPD2353 Approved
0.6556 Remote Similarity NPD2355 Clinical (unspecified phase)
0.6554 Remote Similarity NPD1899 Clinical (unspecified phase)
0.6544 Remote Similarity NPD690 Clinical (unspecified phase)
0.6541 Remote Similarity NPD5889 Approved
0.6541 Remote Similarity NPD7411 Suspended
0.6541 Remote Similarity NPD5890 Approved
0.6522 Remote Similarity NPD5616 Clinical (unspecified phase)
0.651 Remote Similarity NPD1607 Approved
0.6506 Remote Similarity NPD2403 Approved
0.65 Remote Similarity NPD17 Approved
0.65 Remote Similarity NPD6801 Discontinued
0.65 Remote Similarity NPD3412 Clinical (unspecified phase)
0.6497 Remote Similarity NPD5403 Approved
0.649 Remote Similarity NPD1551 Phase 2
0.6483 Remote Similarity NPD9494 Approved
0.6474 Remote Similarity NPD2532 Approved
0.6474 Remote Similarity NPD2534 Approved
0.6474 Remote Similarity NPD2533 Approved
0.6474 Remote Similarity NPD5401 Approved
0.6474 Remote Similarity NPD4661 Approved
0.6474 Remote Similarity NPD4662 Approved
0.6463 Remote Similarity NPD5494 Approved
0.6449 Remote Similarity NPD9493 Approved
0.6443 Remote Similarity NPD1933 Approved
0.6443 Remote Similarity NPD447 Suspended
0.6443 Remote Similarity NPD6355 Discontinued
0.6442 Remote Similarity NPD7075 Discontinued
0.6429 Remote Similarity NPD4628 Phase 3
0.6424 Remote Similarity NPD1510 Phase 2
0.642 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6418 Remote Similarity NPD2067 Discontinued
0.6414 Remote Similarity NPD5647 Approved
0.6412 Remote Similarity NPD164 Approved
0.6392 Remote Similarity NPD3873 Phase 3
0.6392 Remote Similarity NPD3869 Phase 3
0.6387 Remote Similarity NPD3295 Clinical (unspecified phase)
0.6387 Remote Similarity NPD2354 Approved
0.6375 Remote Similarity NPD6585 Discontinued
0.6374 Remote Similarity NPD6765 Approved
0.6374 Remote Similarity NPD6764 Approved
0.6369 Remote Similarity NPD7410 Clinical (unspecified phase)
0.6364 Remote Similarity NPD2654 Approved
0.6364 Remote Similarity NPD1608 Approved
0.6358 Remote Similarity NPD5761 Phase 2
0.6358 Remote Similarity NPD7819 Suspended
0.6358 Remote Similarity NPD5760 Phase 2
0.6357 Remote Similarity NPD9545 Approved
0.6351 Remote Similarity NPD411 Approved
0.6351 Remote Similarity NPD6798 Discontinued
0.6345 Remote Similarity NPD2797 Approved
0.6341 Remote Similarity NPD3749 Approved
0.6331 Remote Similarity NPD2163 Approved
0.6323 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6319 Remote Similarity NPD5402 Approved
0.6319 Remote Similarity NPD3817 Phase 2
0.6316 Remote Similarity NPD3134 Approved
0.6312 Remote Similarity NPD1651 Approved
0.631 Remote Similarity NPD4575 Clinical (unspecified phase)
0.6284 Remote Similarity NPD2598 Clinical (unspecified phase)
0.6275 Remote Similarity NPD2935 Discontinued
0.6269 Remote Similarity NPD1358 Approved
0.6267 Remote Similarity NPD4307 Phase 2
0.625 Remote Similarity NPD957 Approved
0.6241 Remote Similarity NPD1894 Discontinued
0.6231 Remote Similarity NPD1238 Approved
0.6229 Remote Similarity NPD6784 Approved
0.6229 Remote Similarity NPD6785 Approved
0.6226 Remote Similarity NPD5049 Phase 3
0.6226 Remote Similarity NPD6273 Approved
0.6225 Remote Similarity NPD4622 Approved
0.6225 Remote Similarity NPD4618 Approved
0.6222 Remote Similarity NPD2684 Approved
0.6214 Remote Similarity NPD405 Clinical (unspecified phase)
0.6213 Remote Similarity NPD7852 Clinical (unspecified phase)
0.6209 Remote Similarity NPD3748 Approved
0.62 Remote Similarity NPD4062 Phase 3
0.62 Remote Similarity NPD6233 Phase 2
0.6197 Remote Similarity NPD5585 Approved
0.6196 Remote Similarity NPD6844 Discontinued
0.6194 Remote Similarity NPD970 Clinical (unspecified phase)
0.6194 Remote Similarity NPD2897 Discontinued
0.6188 Remote Similarity NPD5586 Clinical (unspecified phase)
0.6185 Remote Similarity NPD6559 Discontinued
0.6184 Remote Similarity NPD6651 Approved
0.6165 Remote Similarity NPD1237 Approved
0.6159 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6154 Remote Similarity NPD1778 Approved
0.6144 Remote Similarity NPD5689 Approved
0.6144 Remote Similarity NPD5688 Approved
0.6135 Remote Similarity NPD958 Approved
0.6133 Remote Similarity NPD1699 Clinical (unspecified phase)
0.6125 Remote Similarity NPD1512 Approved
0.6119 Remote Similarity NPD9697 Approved
0.6111 Remote Similarity NPD2649 Approved
0.6111 Remote Similarity NPD2651 Approved
0.6104 Remote Similarity NPD7033 Discontinued
0.6104 Remote Similarity NPD4308 Phase 3
0.6098 Remote Similarity NPD7577 Discontinued
0.6098 Remote Similarity NPD1934 Approved
0.6093 Remote Similarity NPD8032 Phase 2
0.609 Remote Similarity NPD4534 Discontinued
0.609 Remote Similarity NPD9261 Approved
0.609 Remote Similarity NPD5958 Discontinued
0.6084 Remote Similarity NPD7768 Phase 2
0.6084 Remote Similarity NPD5691 Approved
0.6084 Remote Similarity NPD4196 Clinical (unspecified phase)
0.6074 Remote Similarity NPD4380 Phase 2
0.6069 Remote Similarity NPD1281 Approved
0.6061 Remote Similarity NPD2801 Approved
0.6056 Remote Similarity NPD5536 Phase 2
0.6048 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6047 Remote Similarity NPD3818 Discontinued
0.6043 Remote Similarity NPD7843 Approved
0.6043 Remote Similarity NPD5535 Approved
0.6028 Remote Similarity NPD7157 Approved
0.6026 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6026 Remote Similarity NPD6004 Phase 3
0.6026 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6026 Remote Similarity NPD3764 Approved
0.6026 Remote Similarity NPD6002 Phase 3
0.6026 Remote Similarity NPD6005 Phase 3
0.6026 Remote Similarity NPD6003 Clinical (unspecified phase)
0.6023 Remote Similarity NPD6166 Phase 2
0.6023 Remote Similarity NPD6168 Clinical (unspecified phase)
0.6023 Remote Similarity NPD7784 Clinical (unspecified phase)
0.6023 Remote Similarity NPD6167 Clinical (unspecified phase)
0.6014 Remote Similarity NPD1470 Approved
0.6013 Remote Similarity NPD3750 Approved
0.6012 Remote Similarity NPD7804 Clinical (unspecified phase)
0.6012 Remote Similarity NPD3050 Clinical (unspecified phase)
0.6 Remote Similarity NPD1511 Approved
0.6 Remote Similarity NPD7317 Phase 3
0.6 Remote Similarity NPD3496 Discontinued
0.5988 Remote Similarity NPD6980 Clinical (unspecified phase)
0.5988 Remote Similarity NPD4947 Clinical (unspecified phase)
0.5986 Remote Similarity NPD4359 Approved
0.5978 Remote Similarity NPD6040 Clinical (unspecified phase)
0.5977 Remote Similarity NPD1729 Discontinued
0.5967 Remote Similarity NPD3269 Clinical (unspecified phase)
0.5964 Remote Similarity NPD7972 Discontinued
0.5962 Remote Similarity NPD5712 Approved
0.5962 Remote Similarity NPD4476 Approved
0.5962 Remote Similarity NPD4477 Approved
0.596 Remote Similarity NPD7095 Approved

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL516311
ZINC  

Physicochemical Properties

Molecular Weight:  244.11
ALogP:  1.7392
MLogP:  2.78
XLogP:  1.673
# Rotatable Bonds:  2
Polar Surface Area:  47.28
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  2
# Heavy Atoms:  18

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
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