ID: 44374
SMILES:c1(CCC)cc2c(cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.086
InChIKey:DPBOWJAQCUYVFZ-UHFFFAOYSA-N
ID: 44375
SMILES:C1C2C(C)COC2(C)Oc2cc(CCCCC)c(OC(=O)C)c32C(C)(C=CCC(C)=CC13)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.593
InChIKey:YKCFPGJQGROMDU-UHFFFAOYSA-N
ID: 44376
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 44377
SMILES:OC1C(C(C)(O)C)Oc2c(c(O)cc(CCCCC)c2)C2C3(C(CCC2C)C(C)(O)CC3)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.682
CB1 binding score: -12.845
InChIKey:MFJKQHUTOFXOEN-UHFFFAOYSA-N
ID: 44378
SMILES:C1(c2c(O)cc(CCC)cc2O)(C)CCC(Cl)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.837
CB1 binding score: -14.279
InChIKey:OTTZLFHEDYBHLK-UHFFFAOYSA-N
ID: 44379
SMILES:COC(=O)c1c(C(CCCCC)O)cc(C2C=C(C)C(O)CC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.548
InChIKey:HBNUIUMUEIKRAJ-UHFFFAOYSA-N
ID: 44380
SMILES:c1(O)c2c(cc(O)c1CC=C(C)CCC=C(CCC=C(C)C)C)OC(C)(C)C1C2C(CCc2ccc(O)c(O)c2)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.774
CB1 binding score: -14.145
InChIKey:UMTWDUJLWUJRNW-UHFFFAOYSA-N
ID: 44381
SMILES:CCCCCc1cc(O)c2c(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: 44382
SMILES:C1(C(C)C)(C(=O)O)CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.203
InChIKey:PQQZBMXACVVRRW-UHFFFAOYSA-N
ID: 44383
SMILES:C(CCC)Cc1cc2c(c(O)c1C)OC(C)(C)C1C2C2C(C)(O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.299
InChIKey:VYLPQUZLAIBHOQ-UHFFFAOYSA-N
ID: 44384
SMILES:C1CC2(C)C3(c4c(cc(CCCCC)cc4O)OC13)C(O)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -11.579
InChIKey:QCQFVVAYPZRVBD-UHFFFAOYSA-N
ID: 44385
SMILES:CC1(C)C2CCC(C)CC2c2c(cc(CCCC)c(C(O)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.929
InChIKey:JUSSEUMFPIAMLP-UHFFFAOYSA-N
ID: 44386
SMILES:COc1cc2c(cc1CCCCC)OC1(C3CC(CCC3C)C(C)(C)O1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.597
InChIKey:SUJXIFHWJXLLLK-UHFFFAOYSA-N
ID: 44387
SMILES:C1=CCC2C(C1(C)O)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -13.465
InChIKey:KPTJXTKMBYAFKC-UHFFFAOYSA-N
ID: 44388
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C12)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.123
InChIKey:HOPOPARGOFWFEB-UHFFFAOYSA-N
ID: 44389
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 44390
SMILES:C1C2(C)CCC(C(C)C)C(c3c(O)cc(CCCCC)cc3O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.74
InChIKey:SKSADPIXKHTZBO-UHFFFAOYSA-N
ID: 44391
SMILES:c1(CCCO)c(C(=O)O)c2c(c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.877
InChIKey:MVMMFPWXKUVDSD-UHFFFAOYSA-N
ID: 44392
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(C3C=CC(C)(O1)C3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.869
InChIKey:MIUIYEREOUSIPJ-UHFFFAOYSA-N
ID: 44393
SMILES:O1C2(C)CCC(C(C)C)CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 44394
SMILES:c1(O)c2c(cc(C)c1)OC(C)(C)C1=C2C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.834
InChIKey:LIQGZPACAIISCW-UHFFFAOYSA-N