ID: 131398
SMILES:C1(CCc2ccccc2)=C(O)C2CC(C(C(=CC=CC(=C)CCC=C(C)C)COC)C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.659
CB1 binding score: -12.007
InChIKey:DTSDEIPJWPBEPC-UHFFFAOYSA-N
ID: 131399
SMILES:C12C=C(C(=O)O)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 131400
SMILES:c1(C(O)=O)c(O)c2c(cc1CCCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 131401
SMILES:C1(=O)c2c(O)cc(CCC)cc2OC(C)(CCC=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.427
InChIKey:UICJWNGMMYLYIP-UHFFFAOYSA-N
ID: 131402
SMILES:C(C)c1cc(O)cc(CCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 178.275
CB1 binding score: -17.737
InChIKey:YEKMVCBBXIGWET-UHFFFAOYSA-N
ID: 131403
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 131404
SMILES:O1c2c(c(O)c3c(c2)OC(C)C2CC4CC(C2(C)C)C43)CC1(CC=C(C)C)c1c(C)c(C)c(OC)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.722
CB1 binding score: -16.429
InChIKey:IRUPYQKXXSUVNW-UHFFFAOYSA-N
ID: 131405
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 131406
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1C(=O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.757
InChIKey:FNPUBZJXBKDIKY-UHFFFAOYSA-N
ID: 131407
SMILES:c1(CC=C(C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 131408
SMILES:CC1C(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.993
InChIKey:MUBOGPJKKKCHCA-UHFFFAOYSA-N
ID: 131409
SMILES:CC1(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.944
InChIKey:BNHIPIUQMWYYNY-UHFFFAOYSA-N
ID: 131410
SMILES:Cc1cc(O)c2c(c1)OC1(C)C2(O)C2CCC(C)=CC2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -15.526
InChIKey:OAHXMNHGWUJHBG-UHFFFAOYSA-N
ID: 131411
SMILES:Oc1cc(OC)c2c(cc(O)c(C3C=C(C)CCC3C(C)=C)c2)c1CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -13.905
InChIKey:XPCSTXRRTJHKCT-UHFFFAOYSA-N
ID: 131412
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 131413
SMILES:O=Cc1c(OC2(C(C)C)CCC(C)=CC2)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.313
InChIKey:SSQVKCCFMJWLQR-UHFFFAOYSA-N
ID: 131414
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C=O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.465
InChIKey:VAHVQIKQDGAFDP-UHFFFAOYSA-N
ID: 131415
SMILES:O(C)c1c(C2(CO)OC(C)(C)c3c(cccc3-c3c(O)cc(CC4C(C)C(C)O4)c(O)c3)C(O)=C2)c(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 712.88
CB1 binding score: -13.655
InChIKey:BARATEXEPVBUSE-UHFFFAOYSA-N
ID: 131416
SMILES:COc1cc2c(c(C)c1)OC1(C(=O)OC)C(=C2COC(CCCCCCCCC)=O)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -15.646
InChIKey:YXKKRECOSQSLAV-UHFFFAOYSA-N
ID: 131417
SMILES:O=C(N(C)C)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C3C(=O)C=C(C)C(O)C312
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.552
CB1 binding score: -13.929
InChIKey:IHFFWWBCDPFCBE-UHFFFAOYSA-N
ID: 131418
SMILES:C(Cc1c(O)c(C(=O)C(C)C)c2c(c1O)C1CC(C(=C)C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.057
InChIKey:KNQMKLAZXMTOLA-UHFFFAOYSA-N