ID: 40573
SMILES:C1(C)=CCC(C(C)C)C(c2c(O)c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.425
InChIKey:IHLUNOSAUGVUKL-UHFFFAOYSA-N
ID: 40574
SMILES:C1(C)=CC(O)C2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.567
InChIKey:URRJUSLCXVXZOX-UHFFFAOYSA-N
ID: 40575
SMILES:CC1CCC(C(C)=C)C(c2c(O)c(C(OC)=O)c(CCCCC)c(O)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.767
InChIKey:YAASSQLUZRMLCY-UHFFFAOYSA-N
ID: 40576
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(O)(C)CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 40577
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 40578
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1c2c(O)c(CC=C(CCC=C(C)C)C)c(O)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.374
InChIKey:OZJCCPAUSRUTCI-UHFFFAOYSA-N
ID: 40579
SMILES:OC1(C)C(O)C2C(C(O)C(OC)(O)C1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.4
CB1 binding score: -12.167
InChIKey:HJWJOFDTHBUOEP-UHFFFAOYSA-N
ID: 40580
SMILES:C1C(CCC(C(C)(O)C)O)(C)Oc2cc(CCCCC)c(C(=O)O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.192
InChIKey:MHIDJSDETPVMEL-UHFFFAOYSA-N
ID: 40581
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)cc(O)cc1CCc1ccccc1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -16.23
InChIKey:CZIADHCRKVVFNB-UHFFFAOYSA-N
ID: 40582
SMILES:Cc1c(C(C)=C)c(OC)c(OC)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.812
InChIKey:XFOXZGFUHNJJQW-UHFFFAOYSA-N
ID: 40583
SMILES:C12=CCC(C)=CC1C(C1(C)OC(C)(C)C=C(Cl)C1=O)CC(OC(=O)C)=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.907
CB1 binding score: -15.379
InChIKey:CDWHGXQZRFCTIL-UHFFFAOYSA-N
ID: 40584
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 40585
SMILES:C1CC2C(C)(C)Oc3cc(CCCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 40586
SMILES:CC1CCC(=O)C2Cc3cc(ccc3)Oc3c(O)c(C(=O)OC)c(CCCCC)cc3OC(C2(CCC=C(C)C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.746
CB1 binding score: -14.246
InChIKey:XFSISPZWQMOOFP-UHFFFAOYSA-N
ID: 40587
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.218
InChIKey:CNCURDLLOPZUIO-UHFFFAOYSA-N
ID: 40588
SMILES:CCC=CCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.265
InChIKey:RGYKKFHRTWPLQH-UHFFFAOYSA-N
ID: 40589
SMILES:c1(O)cc(C)cc2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.328
InChIKey:IWHYDYORMMBLMI-UHFFFAOYSA-N
ID: 40590
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(C=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.956
InChIKey:KZZGLSUGCLMLNA-UHFFFAOYSA-N
ID: 40591
SMILES:C1Cc2c(O)cc(C(C)C(C(C)CC)=O)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.426
InChIKey:OPXYQNBYMZXSTM-UHFFFAOYSA-N
ID: 40592
SMILES:OC1Cc2c(O)c3c(cc2CCCCC)OC(C)(C)C1CC=C(C)CCC=C(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.438
InChIKey:HVOJUEYWMRGBBV-UHFFFAOYSA-N
ID: 40593
SMILES:O1C(C)CC(O)C(O)C1OCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -16.502
InChIKey:WDCJVZXEXHRBMW-UHFFFAOYSA-N