ID: 31627
SMILES:c12c(O)cc(CCCCC)cc1OC1(C2)C(C)=CC(=O)c2c(C)cc(O)c3c2C=CC(=C)C13
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.555
CB1 binding score: -16.921
InChIKey:QGWTVGMMMBIYIM-UHFFFAOYSA-N
ID: 31628
SMILES:C(CCCC)c1cc(O)c(Cc2c(O)cc(CCCCC)cc2O)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -14.847
InChIKey:JFAJXOFHSFLSBR-UHFFFAOYSA-N
ID: 31629
SMILES:C(c1cc(O)c2c(c1)OC(C1(C)CCC(C(O)(C)C)O1)(C)C2C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.899
InChIKey:WLLFBKJXDBJRAI-UHFFFAOYSA-N
ID: 31630
SMILES:O=C(CC(C)C)C(c1c(O)c2c(cc1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.317
InChIKey:VUYRTRNZYHTKPC-UHFFFAOYSA-N
ID: 31631
SMILES:C(CCCCCC)CCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.163
InChIKey:SUCNEGRXNRDXJO-UHFFFAOYSA-N
ID: 31632
SMILES:C1(C)(C)C2C(O)C(C=C3c4c(cc(CCCCC)cc4O)OC(O)C3(C)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -12.358
InChIKey:YICPWJJUSNZFEL-UHFFFAOYSA-N
ID: 31633
SMILES:c1(O)c2c(cc(O)cc2)OC(C)(CC=CC(C)(O)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.312
InChIKey:OPGWSRVDBJJQCF-UHFFFAOYSA-N
ID: 31634
SMILES:Oc1cc(CCCC)cc2c1CC(C(C)(C)O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -17.47
InChIKey:GJTUSTFPHCMTJJ-UHFFFAOYSA-N
ID: 31635
SMILES:O1C2C(=C(c3c(O)cc(CCCCC)cc3O)O1)C=C1OC(C)(C)C(=O)C1CC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -15.114
InChIKey:BYNAPTOARNROHJ-UHFFFAOYSA-N
ID: 31636
SMILES:CC(C1C2CC(=C)CC2c2c(O)cc(CCCCC)cc2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.809
InChIKey:XQYDUCHQZIDLNU-UHFFFAOYSA-N
ID: 31637
SMILES:c1(OCC)c(CCCCC)cc2c(c1O)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.299
InChIKey:DIEAJJWWRXSROP-UHFFFAOYSA-N
ID: 31638
SMILES:C(C)(C=O)(C1Cc2c(cc(CCCCC)cc2O)OC1C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -12.197
InChIKey:WUYFDYXJGBJDGO-UHFFFAOYSA-N
ID: 31639
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.771
InChIKey:VGSHJKOXKGYENI-UHFFFAOYSA-N
ID: 31640
SMILES:c1(CCC)cc2c(c(O)c1)C1CC(C)(CCC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.148
InChIKey:ZTXURIOACGYUBQ-UHFFFAOYSA-N
ID: 31641
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1cc(CCCCC)cc(OC3C(O)C(O)C(O)C(CO)O3)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -17.362
InChIKey:SAAFXEQPFHGQNP-UHFFFAOYSA-N
ID: 31642
SMILES:CCC(C)CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.902
InChIKey:WKBRCDQAVOUNEI-UHFFFAOYSA-N
ID: 31643
SMILES:c1(OC)c(CCCCC)cc(O)c2c1OC(CCC=C(C)C)(C)C(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.684
InChIKey:QIUMGWRZGSIWAJ-UHFFFAOYSA-N
ID: 31644
SMILES:C1(C)(CCCC(O)(CCC2C(C)=CCC(=O)C2(C)C)C)Oc2cc3c(cc21)OC(C)(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -14.045
InChIKey:QWHMUBPXFXBPLU-UHFFFAOYSA-N
ID: 31645
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1=CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.625
InChIKey:BYMQCAKKRCRSDN-UHFFFAOYSA-N
ID: 31646
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1(O)C(O)(C(C(CC)C)=O)C(=O)C(C)=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.567
CB1 binding score: -15.506
InChIKey:IXUOPCBRIBMTIN-UHFFFAOYSA-N
ID: 31647
SMILES:C(CCCC)c1cc(O)c(CC=C(CCC=C(C)C)C=O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.748
InChIKey:HSKNOSOMHLHOGU-UHFFFAOYSA-N