ID: 107332
SMILES:c1(=O)c(CC=C(C)C)c2c3c4c(c1OC)C1C=C(CCC5C(C)(C)OC(=O)CC(O)C45OC1(C)O3)C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.638
CB1 binding score: -15.407
InChIKey:GHMJTJCSDWLPNT-UHFFFAOYSA-N
ID: 107333
SMILES:C(CCCC)c1cc2c(c(OC)c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.7
InChIKey:CXDMDOGDTCMJBD-UHFFFAOYSA-N
ID: 107334
SMILES:c1c(O)c(CC=C(CCC=C(C)C)C)c(CC=C(C)C)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: -16.95
InChIKey:DCEGHEOFPYHZDF-UHFFFAOYSA-N
ID: 107335
SMILES:c1c(CCI)c2c(cc1C)OC(C)(C)C=C(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.202
CB1 binding score: -15.652
InChIKey:UVQOEXLKLHWMJZ-UHFFFAOYSA-N
ID: 107336
SMILES:c1c(Cl)c2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.806
CB1 binding score: -15.276
InChIKey:UFGXHPXYMGGJBY-UHFFFAOYSA-N
ID: 107337
SMILES:C(C(O)(C)CC1c2c(O)cc(C)cc2OC1(CCC=C(C)C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.12
InChIKey:JHKHCAGWWPVSGG-UHFFFAOYSA-N
ID: 107338
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)OCCO)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.633
InChIKey:WKFOPAUKROAYBQ-UHFFFAOYSA-N
ID: 107339
SMILES:CC1(C)Oc2c(c(O)c(OC)c(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.277
InChIKey:WJABVLUXMBMMIO-UHFFFAOYSA-N
ID: 107340
SMILES:c1(C(C=C)C(OC)=O)c(O)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -11.831
InChIKey:KPVZHQWUIFBOQU-UHFFFAOYSA-N
ID: 107341
SMILES:CCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 107342
SMILES:CC(CCC=C(C)C)=CCCC1(C)C(O)Cc2c(cc(CCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.356
InChIKey:CCJCVCBQKVWRPL-UHFFFAOYSA-N
ID: 107343
SMILES:Oc1cc(C2C=C(C)CCC2C(=C)C)c(O)c(CCC(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.548
InChIKey:GRANJPWATWEXSO-UHFFFAOYSA-N
ID: 107344
SMILES:C12C3C(CCC1C)C(C)(C)Oc1c2c(c(C)cc1O)OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.6
InChIKey:ARLSTFOBGAQJJY-UHFFFAOYSA-N
ID: 107345
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 222.284
CB1 binding score: -16.7
InChIKey:XZWYKOFKGVNGQV-UHFFFAOYSA-N
ID: 107346
SMILES:C(=C(C)C)C(=O)CC(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.097
InChIKey:LWYUELNZKAAHMD-UHFFFAOYSA-N
ID: 107347
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 107348
SMILES:C1(C(C)C)Cc2cc(ccc2O)OC(C)(C)C(O)CCC2(O)C(CCCCCC)C2=C(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -16.449
InChIKey:MFIKVFXWRBLFOX-UHFFFAOYSA-N
ID: 107349
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -16.381
InChIKey:UVNQGAUSDZLCRC-UHFFFAOYSA-N
ID: 107350
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(C(=O)OC)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.002
InChIKey:HUZMPUWOMFDYCE-UHFFFAOYSA-N
ID: 107351
SMILES:C(CC=C(C)C)C1(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.758
InChIKey:BBSLEQVLKFGGIE-UHFFFAOYSA-N
ID: 107352
SMILES:CC(C1C2c3c(cc(CCCCC)cc3O1)CC(CCC=C(C)C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -17.188
InChIKey:VSRRMXWLNKXTPP-UHFFFAOYSA-N