ID: 91393
SMILES:C1(C)=C(c2c(O)cc(CCCCC)cc2O)OC2C13CCC(C)(C#CCC(C)=C2)C(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -15.468
InChIKey:ZDNRAOATSHLIBV-UHFFFAOYSA-N
ID: 91394
SMILES:C1(C2C3C(C(C)(C)Oc4cc(CCC(C(=O)O)C)cc(O)c4C3c3cc(CCO)cc(O)c3O)C2)(C)CCCC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 594.789
CB1 binding score: -15.58
InChIKey:PLUQUJNCTYFFSO-UHFFFAOYSA-N
ID: 91395
SMILES:CC1C2Cc3c(O)cc(CCCCC)cc3OC(C)(CCC2)CCC(C)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -16.771
InChIKey:WUMRZDWREKFDQV-UHFFFAOYSA-N
ID: 91396
SMILES:c12c(cc(CCCCC)c(C(=O)OC(=O)C)c1O)CC(C(=C)C)CCC1=CC(C=C(C)C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -14.454
InChIKey:CHOOSRZUNZTXLC-UHFFFAOYSA-N
ID: 91397
SMILES:O1C2C13c1c(cc(CCCCC)cc1O)OC(C)(C)C1C3C(C)(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.71
InChIKey:LZSBEFUUANPJOL-UHFFFAOYSA-N
ID: 91398
SMILES:C1C=C(C)CC(c2c(O)cc(C(C)(CCCCCCC)O)cc2O)C1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.591
CB1 binding score: -16.193
InChIKey:BHUYJQHKTPPDOC-UHFFFAOYSA-N
ID: 91399
SMILES:O1c2c(c(O)cc(CCCCCO)c2)C2(C)C=CC3(C(C)(C)C(C)CCC3=O)OC12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.521
InChIKey:HNSAGJWUWCERRV-UHFFFAOYSA-N
ID: 91400
SMILES:C(CC(C)C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.444
InChIKey:BRVQKRFELCNHPR-UHFFFAOYSA-N
ID: 91401
SMILES:C1=C(C)CC2c3cc(cc(C)c3)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -15.717
InChIKey:FKLROUBZSFSLNH-UHFFFAOYSA-N
ID: 91402
SMILES:C1(C)(C=C)C(=C(C=O)C)C(c2c(O)cc(CCCCC)cc2O)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.502
InChIKey:CDUZEQRGAMFAKZ-UHFFFAOYSA-N
ID: 91403
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCCC)cc(OC)c2C=C1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -18.505
InChIKey:HDFDVFHITGCJEG-UHFFFAOYSA-N
ID: 91404
SMILES:C1C2C(C)(CCC(O)C2(C)C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.936
InChIKey:MBLABEJDSVQROM-UHFFFAOYSA-N
ID: 91405
SMILES:c1(O)cc(C)cc2c1-c1c(cc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.436
InChIKey:CHFXDOPZZGIIGB-UHFFFAOYSA-N
ID: 91406
SMILES:C1=CC(Cc2c(OC(C(C)C)=O)cc(CCCCC)cc2OC)C(C(CO)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.024
InChIKey:DYXNVBBMBVFOIA-UHFFFAOYSA-N
ID: 91407
SMILES:C1CC(O)(C)C2C(c3c(cc(CCCCC)cc3O)O2)C1C(CCC=C(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.21
InChIKey:JVZOZZUGRKCFIN-UHFFFAOYSA-N
ID: 91408
SMILES:C(CCC)Cc1cc2c(c(O)c1O)C1CC(CO)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.963
InChIKey:MXJFPYUTYUKPKB-UHFFFAOYSA-N
ID: 91409
SMILES:C1(C)(C)OC2(C)C3CC(O)C(C)=C3C(=O)C1(O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.859
InChIKey:ZPQCMXWEDVNAFO-UHFFFAOYSA-N
ID: 91410
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91411
SMILES:C(CC)Cc1cc(O)c(C2C(=O)C(C)(C)C3C(C)(C)C2CC3)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.39
InChIKey:VDQUWYBEVHBKTH-UHFFFAOYSA-N
ID: 91412
SMILES:c1ccccc1CC(=CCCC(=CCCC(C)=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -14.836
InChIKey:YDULXKLWPGUUBC-UHFFFAOYSA-N
ID: 91413
SMILES:CC(=O)Oc1c(OC(C)=O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -15.526
InChIKey:KSMKCXHGPQQOTL-UHFFFAOYSA-N