Natural Product: NPC211594

Natural Product ID:  NPC211594
Common Name:   Lantanone
IUPAC Name:   [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate
Synonyms:   lantanone
Molecular Formula:   C25H26O12
Standard InCHIKey:  FHBWUJAADRENKL-SDPBRJMTSA-N
Standard InCHI:  InChI=1S/C25H26O12/c1-11(26)34-10-18-20(28)22(30)23(31)25(37-18)36-17-9-16-19(21(29)24(17)33-3)14(27)8-15(35-16)12-4-6-13(32-2)7-5-12/h4-9,18,20,22-23,25,28-31H,10H2,1-3H3/t18-,20-,22+,23-,25-/m1/s1
Canonical SMILES:  COc1c(O[C@@H]2O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]2O)O)O)cc2c(c1O)c(=O)cc(o2)c1ccc(cc1)OC
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
NPO1859 Lantana camara Species Verbenaceae Eukaryota Aerial parts PMID[10869197]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT450 Organism Meloidogyne incognita Meloidogyne incognita Activity = 95 % 3210015
NPT450 Organism Meloidogyne incognita Meloidogyne incognita Activity = 90 % 10.1007/s00044-010-9338-x

  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 NPC211594 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 NPC172807
1.0 High Similarity NPC254540
0.9877 High Similarity NPC477848
0.9875 High Similarity NPC201292
0.9875 High Similarity NPC226294
0.9875 High Similarity NPC469931
0.9875 High Similarity NPC186807
0.9875 High Similarity NPC58053
0.9875 High Similarity NPC93337
0.9875 High Similarity NPC475942
0.9875 High Similarity NPC45638
0.9875 High Similarity NPC105025
0.9816 High Similarity NPC211532
0.9816 High Similarity NPC472385
0.9816 High Similarity NPC233994
0.9816 High Similarity NPC198324
0.9812 High Similarity NPC58716
0.9812 High Similarity NPC146792
0.9812 High Similarity NPC45618
0.9755 High Similarity NPC264735
0.9755 High Similarity NPC115760
0.9755 High Similarity NPC135277
0.9755 High Similarity NPC101191
0.9755 High Similarity NPC210094
0.9755 High Similarity NPC49344
0.9755 High Similarity NPC237435
0.9755 High Similarity NPC43211
0.9753 High Similarity NPC205076
0.9753 High Similarity NPC476405
0.9753 High Similarity NPC307518
0.9753 High Similarity NPC117260
0.9753 High Similarity NPC48773
0.9753 High Similarity NPC472386
0.9695 High Similarity NPC472991
0.9695 High Similarity NPC472992
0.9693 High Similarity NPC21666
0.9693 High Similarity NPC169977
0.9693 High Similarity NPC204693
0.9693 High Similarity NPC101026
0.9693 High Similarity NPC24043
0.9693 High Similarity NPC45522
0.9693 High Similarity NPC4390
0.9693 High Similarity NPC42773
0.9691 High Similarity NPC245014
0.9691 High Similarity NPC282987
0.9691 High Similarity NPC22195
0.9691 High Similarity NPC84265
0.9691 High Similarity NPC183357
0.9691 High Similarity NPC224462
0.9691 High Similarity NPC105511
0.9691 High Similarity NPC21190
0.9689 High Similarity NPC116745
0.9688 High Similarity NPC311830
0.9688 High Similarity NPC22832
0.9632 High Similarity NPC3583
0.9632 High Similarity NPC153755
0.9632 High Similarity NPC175107
0.9632 High Similarity NPC259152
0.9632 High Similarity NPC190003
0.963 High Similarity NPC95855
0.963 High Similarity NPC472383
0.963 High Similarity NPC112755
0.963 High Similarity NPC170675
0.963 High Similarity NPC471457
0.963 High Similarity NPC472381
0.963 High Similarity NPC210042
0.9627 High Similarity NPC99957
0.9627 High Similarity NPC181616
0.9625 High Similarity NPC284960
0.9625 High Similarity NPC88023
0.9625 High Similarity NPC191306
0.9625 High Similarity NPC309025
0.9625 High Similarity NPC270335
0.9625 High Similarity NPC94777
0.9625 High Similarity NPC19709
0.9625 High Similarity NPC222936
0.9625 High Similarity NPC243930
0.9581 High Similarity NPC36138
0.9581 High Similarity NPC470445
0.9581 High Similarity NPC470446
0.9581 High Similarity NPC470449
0.9581 High Similarity NPC470447
0.9576 High Similarity NPC169733
0.9576 High Similarity NPC472382
0.9576 High Similarity NPC268533
0.9576 High Similarity NPC472380
0.9576 High Similarity NPC472384
0.9573 High Similarity NPC472993
0.9573 High Similarity NPC175230
0.9573 High Similarity NPC51774
0.9573 High Similarity NPC88560
0.9573 High Similarity NPC172033
0.9573 High Similarity NPC236191
0.9573 High Similarity NPC239549
0.9571 High Similarity NPC20505
0.9571 High Similarity NPC244776
0.9571 High Similarity NPC44558
0.9571 High Similarity NPC116864
0.9571 High Similarity NPC149011
0.9571 High Similarity NPC34287
0.9571 High Similarity NPC474434
0.9571 High Similarity NPC155763
0.9571 High Similarity NPC471416
0.9571 High Similarity NPC204937
0.9571 High Similarity NPC235260
0.9568 High Similarity NPC135345
0.9568 High Similarity NPC229729
0.9568 High Similarity NPC93099
0.9563 High Similarity NPC473043
0.9563 High Similarity NPC189142
0.9563 High Similarity NPC77660
0.9524 High Similarity NPC470416
0.9524 High Similarity NPC470455
0.9524 High Similarity NPC470451
0.9521 High Similarity NPC222674
0.9518 High Similarity NPC476621
0.9518 High Similarity NPC476623
0.9518 High Similarity NPC476620
0.9518 High Similarity NPC472387
0.9518 High Similarity NPC476618
0.9518 High Similarity NPC476622
0.9518 High Similarity NPC476619
0.9518 High Similarity NPC168584
0.9515 High Similarity NPC472607
0.9512 High Similarity NPC267254
0.9512 High Similarity NPC301683
0.9509 High Similarity NPC225434
0.9509 High Similarity NPC209296
0.9509 High Similarity NPC203050
0.9509 High Similarity NPC223747
0.9509 High Similarity NPC229687
0.9509 High Similarity NPC138927
0.9509 High Similarity NPC120099
0.9509 High Similarity NPC195257
0.9509 High Similarity NPC219904
0.9509 High Similarity NPC183036
0.9506 High Similarity NPC21100
0.9506 High Similarity NPC236934
0.9506 High Similarity NPC5778
0.9506 High Similarity NPC197285
0.9506 High Similarity NPC210073
0.9506 High Similarity NPC115674
0.9503 High Similarity NPC168822
0.9503 High Similarity NPC88043
0.95 High Similarity NPC182045
0.95 High Similarity NPC217950
0.9464 High Similarity NPC107987
0.9461 High Similarity NPC473682
0.9461 High Similarity NPC126784
0.9461 High Similarity NPC470443
0.9461 High Similarity NPC470444
0.9461 High Similarity NPC110941
0.9461 High Similarity NPC241423
0.9461 High Similarity NPC473571
0.9458 High Similarity NPC65563
0.9458 High Similarity NPC8573
0.9458 High Similarity NPC470949
0.9451 High Similarity NPC51326
0.9451 High Similarity NPC206123
0.9451 High Similarity NPC231194
0.9448 High Similarity NPC84362
0.9448 High Similarity NPC317489
0.9448 High Similarity NPC325555
0.9448 High Similarity NPC265530
0.9448 High Similarity NPC52550
0.9448 High Similarity NPC226304
0.9448 High Similarity NPC127546
0.9448 High Similarity NPC223424
0.9448 High Similarity NPC45400
0.9448 High Similarity NPC173637
0.9444 High Similarity NPC165720
0.9444 High Similarity NPC277205
0.9441 High Similarity NPC127782
0.9441 High Similarity NPC300537
0.9437 High Similarity NPC110349
0.9405 High Similarity NPC473071
0.9405 High Similarity NPC473073
0.9401 High Similarity NPC120952
0.9401 High Similarity NPC173837
0.9401 High Similarity NPC139571
0.9401 High Similarity NPC217520
0.9401 High Similarity NPC35167
0.9398 High Similarity NPC102028
0.9398 High Similarity NPC253685
0.9398 High Similarity NPC142996
0.9394 High Similarity NPC256760
0.9394 High Similarity NPC235575
0.9394 High Similarity NPC156977
0.9394 High Similarity NPC475155
0.939 High Similarity NPC86008
0.939 High Similarity NPC471287
0.9387 High Similarity NPC274618
0.9387 High Similarity NPC56077
0.9387 High Similarity NPC118284
0.9387 High Similarity NPC277174
0.9387 High Similarity NPC145038
0.9387 High Similarity NPC73855
0.9387 High Similarity NPC328940
0.9387 High Similarity NPC135599
0.9387 High Similarity NPC308404

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC211594 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
0.9755 High Similarity NPD4338 Clinical (unspecified phase)
0.9509 High Similarity NPD7054 Approved
0.9451 High Similarity NPD7472 Approved
0.9333 High Similarity NPD7074 Phase 3
0.9329 High Similarity NPD3818 Discontinued
0.9277 High Similarity NPD6797 Phase 2
0.9222 High Similarity NPD7251 Discontinued
0.9167 High Similarity NPD7808 Phase 3
0.9125 High Similarity NPD2801 Approved
0.9074 High Similarity NPD4381 Clinical (unspecified phase)
0.8944 High Similarity NPD1934 Approved
0.8862 High Similarity NPD6168 Clinical (unspecified phase)
0.8862 High Similarity NPD6166 Phase 2
0.8862 High Similarity NPD6167 Clinical (unspecified phase)
0.8834 High Similarity NPD3817 Phase 2
0.878 High Similarity NPD4868 Clinical (unspecified phase)
0.8773 High Similarity NPD2393 Clinical (unspecified phase)
0.8706 High Similarity NPD7804 Clinical (unspecified phase)
0.8606 High Similarity NPD5402 Approved
0.858 High Similarity NPD1653 Approved
0.8562 High Similarity NPD1511 Approved
0.8554 High Similarity NPD3882 Suspended
0.8476 Intermediate Similarity NPD4380 Phase 2
0.8457 Intermediate Similarity NPD1512 Approved
0.8448 Intermediate Similarity NPD6559 Discontinued
0.8402 Intermediate Similarity NPD5494 Approved
0.8393 Intermediate Similarity NPD7075 Discontinued
0.8391 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.8382 Intermediate Similarity NPD5844 Phase 1
0.8263 Intermediate Similarity NPD6801 Discontinued
0.8239 Intermediate Similarity NPD7685 Pre-registration
0.8232 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.8214 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.8214 Intermediate Similarity NPD1465 Phase 2
0.8198 Intermediate Similarity NPD6232 Discontinued
0.8182 Intermediate Similarity NPD5403 Approved
0.8161 Intermediate Similarity NPD7473 Discontinued
0.8122 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.8114 Intermediate Similarity NPD7228 Approved
0.811 Intermediate Similarity NPD6799 Approved
0.8107 Intermediate Similarity NPD7819 Suspended
0.8095 Intermediate Similarity NPD7411 Suspended
0.8075 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.8075 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.8072 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.8061 Intermediate Similarity NPD5401 Approved
0.8061 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.8035 Intermediate Similarity NPD7199 Phase 2
0.8025 Intermediate Similarity NPD1549 Phase 2
0.8023 Intermediate Similarity NPD6234 Discontinued
0.7956 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7953 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7944 Intermediate Similarity NPD8313 Approved
0.7944 Intermediate Similarity NPD8312 Approved
0.7941 Intermediate Similarity NPD37 Approved
0.7927 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.791 Intermediate Similarity NPD3751 Discontinued
0.7907 Intermediate Similarity NPD4965 Approved
0.7907 Intermediate Similarity NPD4967 Phase 2
0.7907 Intermediate Similarity NPD4966 Approved
0.7901 Intermediate Similarity NPD2796 Approved
0.7886 Intermediate Similarity NPD3787 Discontinued
0.7853 Intermediate Similarity NPD7266 Discontinued
0.7844 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7841 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.784 Intermediate Similarity NPD1510 Phase 2
0.7829 Intermediate Similarity NPD6959 Discontinued
0.7824 Intermediate Similarity NPD6599 Discontinued
0.7805 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7801 Intermediate Similarity NPD7435 Discontinued
0.7797 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7771 Intermediate Similarity NPD6190 Approved
0.7764 Intermediate Similarity NPD1933 Approved
0.7764 Intermediate Similarity NPD230 Phase 1
0.7737 Intermediate Similarity NPD6777 Approved
0.7737 Intermediate Similarity NPD6781 Approved
0.7737 Intermediate Similarity NPD6778 Approved
0.7737 Intermediate Similarity NPD6776 Approved
0.7737 Intermediate Similarity NPD6779 Approved
0.7737 Intermediate Similarity NPD6782 Approved
0.7737 Intermediate Similarity NPD6780 Approved
0.7727 Intermediate Similarity NPD1247 Approved
0.7714 Intermediate Similarity NPD919 Approved
0.7711 Intermediate Similarity NPD3750 Approved
0.7704 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7704 Intermediate Similarity NPD7783 Phase 2
0.7702 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7702 Intermediate Similarity NPD1613 Approved
0.7692 Intermediate Similarity NPD8151 Discontinued
0.7683 Intermediate Similarity NPD2935 Discontinued
0.7657 Intermediate Similarity NPD3749 Approved
0.7654 Intermediate Similarity NPD447 Suspended
0.7637 Intermediate Similarity NPD7240 Approved
0.7605 Intermediate Similarity NPD4628 Phase 3
0.76 Intermediate Similarity NPD7768 Phase 2
0.7593 Intermediate Similarity NPD1240 Approved
0.7593 Intermediate Similarity NPD943 Approved
0.759 Intermediate Similarity NPD7584 Approved
0.7586 Intermediate Similarity NPD8455 Phase 2
0.7578 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7576 Intermediate Similarity NPD1551 Phase 2
0.7563 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7563 Intermediate Similarity NPD7874 Approved
0.7542 Intermediate Similarity NPD3926 Phase 2
0.7529 Intermediate Similarity NPD2533 Approved
0.7529 Intermediate Similarity NPD2534 Approved
0.7529 Intermediate Similarity NPD2532 Approved
0.7526 Intermediate Similarity NPD7696 Phase 3
0.7526 Intermediate Similarity NPD7697 Approved
0.7526 Intermediate Similarity NPD7698 Approved
0.7516 Intermediate Similarity NPD3027 Phase 3
0.75 Intermediate Similarity NPD1607 Approved
0.7487 Intermediate Similarity NPD7870 Phase 2
0.7487 Intermediate Similarity NPD7871 Phase 2
0.7474 Intermediate Similarity NPD6534 Approved
0.7474 Intermediate Similarity NPD6535 Approved
0.7474 Intermediate Similarity NPD6823 Phase 2
0.7462 Intermediate Similarity NPD7701 Phase 2
0.7453 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7442 Intermediate Similarity NPD920 Approved
0.744 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.741 Intermediate Similarity NPD3748 Approved
0.7396 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7391 Intermediate Similarity NPD5953 Discontinued
0.7391 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7374 Intermediate Similarity NPD7585 Approved
0.7358 Intermediate Similarity NPD7700 Phase 2
0.7358 Intermediate Similarity NPD7699 Phase 2
0.7356 Intermediate Similarity NPD3226 Approved
0.735 Intermediate Similarity NPD7801 Approved
0.734 Intermediate Similarity NPD8434 Phase 2
0.734 Intermediate Similarity NPD8150 Discontinued
0.733 Intermediate Similarity NPD6844 Discontinued
0.7326 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7323 Intermediate Similarity NPD7583 Approved
0.732 Intermediate Similarity NPD7237 Clinical (unspecified phase)
0.7305 Intermediate Similarity NPD7033 Discontinued
0.7283 Intermediate Similarity NPD7286 Phase 2
0.7282 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7259 Intermediate Similarity NPD7680 Approved
0.7257 Intermediate Similarity NPD7458 Discontinued
0.7256 Intermediate Similarity NPD2313 Discontinued
0.7247 Intermediate Similarity NPD5353 Approved
0.724 Intermediate Similarity NPD6213 Phase 3
0.724 Intermediate Similarity NPD6212 Phase 3
0.724 Intermediate Similarity NPD6214 Clinical (unspecified phase)
0.7239 Intermediate Similarity NPD6832 Phase 2
0.7235 Intermediate Similarity NPD1652 Phase 2
0.7235 Intermediate Similarity NPD1243 Approved
0.7235 Intermediate Similarity NPD2800 Approved
0.7222 Intermediate Similarity NPD8319 Approved
0.7222 Intermediate Similarity NPD8320 Phase 1
0.7219 Intermediate Similarity NPD2346 Discontinued
0.7212 Intermediate Similarity NPD6233 Phase 2
0.7209 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD2799 Discontinued
0.7198 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7178 Intermediate Similarity NPD9494 Approved
0.716 Intermediate Similarity NPD1203 Approved
0.7158 Intermediate Similarity NPD5242 Approved
0.7135 Intermediate Similarity NPD6674 Discontinued
0.7128 Intermediate Similarity NPD7549 Discontinued
0.7128 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD5124 Phase 1
0.7125 Intermediate Similarity NPD1091 Approved
0.7121 Intermediate Similarity NPD5005 Approved
0.7121 Intermediate Similarity NPD5006 Approved
0.712 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD4360 Phase 2
0.7113 Intermediate Similarity NPD4363 Phase 3
0.7104 Intermediate Similarity NPD5710 Approved
0.7104 Intermediate Similarity NPD5711 Approved
0.7093 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7081 Intermediate Similarity NPD9269 Phase 2
0.7079 Intermediate Similarity NPD6386 Approved
0.7079 Intermediate Similarity NPD6385 Approved
0.7079 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7062 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD6100 Approved
0.7059 Intermediate Similarity NPD6099 Approved
0.7053 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.7049 Intermediate Similarity NPD8127 Discontinued
0.7048 Intermediate Similarity NPD3268 Approved
0.7048 Intermediate Similarity NPD5619 Clinical (unspecified phase)
0.7048 Intermediate Similarity NPD6798 Discontinued
0.7037 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.703 Intermediate Similarity NPD4908 Phase 1
0.7019 Intermediate Similarity NPD422 Phase 1
0.7018 Intermediate Similarity NPD2344 Approved
0.7012 Intermediate Similarity NPD2798 Approved
0.7005 Intermediate Similarity NPD4420 Approved
0.6994 Remote Similarity NPD3225 Approved
0.699 Remote Similarity NPD7930 Approved
0.6984 Remote Similarity NPD7039 Approved
0.6984 Remote Similarity NPD7038 Approved

Structure

External Identifiers

PubChem CID   10744475
ChEMBL   CHEMBL496041
ZINC  

Physicochemical Properties

Molecular Weight:  518.14
ALogP:  -2.8956
MLogP:  2.89
XLogP:  0.845
# Rotatable Bonds:  15
Polar Surface Area:  170.44
# H-Bond Aceptor:  7
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  37

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs