ID: 105463
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2C1CCC(=C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.067
InChIKey:HRWSDIFPFHPUTH-UHFFFAOYSA-N
ID: 105464
SMILES:c1cc(CCCCC)cc(O)c1C1CC(C)(C)CC1C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.632
CB1 binding score: -13.532
InChIKey:SCGCDAADGGHXAM-UHFFFAOYSA-N
ID: 105465
SMILES:CC(C1CCC(C)CC1c1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 105466
SMILES:c1c(O)cc(C)cc1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.706
InChIKey:FBXSVXARSUKKDJ-UHFFFAOYSA-N
ID: 105467
SMILES:c12c(cc(O)cc1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 105468
SMILES:C(CCc1cc(O)c2c(c1)OC(C(C)(C)O)C2)(CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -12.508
InChIKey:FGPGRPYKTDIUBK-UHFFFAOYSA-N
ID: 105469
SMILES:CC(C)=CC(C(=O)O)CC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -12.869
InChIKey:NXJBSAAKCGVITA-UHFFFAOYSA-N
ID: 105470
SMILES:Oc1cc(O)c(C(=O)CC(C)C)c2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 105471
SMILES:c1(CCCCCCCCCCC)cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.178
InChIKey:WPOBAFZFSMXJFI-UHFFFAOYSA-N
ID: 105472
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C(=O)CC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:VMDONILZKKAZDT-UHFFFAOYSA-N
ID: 105473
SMILES:c1(O)c(O)c(C(=O)O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -13.961
InChIKey:KLFNJSIQSGHVTL-UHFFFAOYSA-N
ID: 105474
SMILES:C(C=C(C)C)CC1(C)C(Cc2c(O)cc(CCCCC)cc2O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -14.673
InChIKey:SICAMMNTHQKZSF-UHFFFAOYSA-N
ID: 105475
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 105476
SMILES:c1(C2C=C(C)CCC2C(=C)C)cc(O)c(CC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -15.514
InChIKey:FITXLFPJLVDZNZ-UHFFFAOYSA-N
ID: 105477
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C3(C(C)CCC13)C(O)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.99
InChIKey:DUMIDGPESLUTMG-UHFFFAOYSA-N
ID: 105478
SMILES:O(C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC(=C)C1O)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.762
InChIKey:DOUVYLPYWIUXQU-UHFFFAOYSA-N
ID: 105479
SMILES:Oc1c(C)cc(O)cc1CC=C(CCC1(C(=C)CCC(=O)C(C)(C)CCC=C(C)C)C(=O)C(O)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -14.637
InChIKey:CYIIHXHJNVWHHP-UHFFFAOYSA-N
ID: 105480
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 105481
SMILES:CC1CC(O)c2c(OC)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -14.943
InChIKey:DOHYHNBDFZKBDO-UHFFFAOYSA-N
ID: 105482
SMILES:CC(c1c2c(c(O)cc1OC)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.852
InChIKey:NMWKGZZZOKRWIO-UHFFFAOYSA-N
ID: 105483
SMILES:C(CCC1(C)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCc2c1c(O)c(OC)c(C(C)C)c2)(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.725
CB1 binding score: -15.826
InChIKey:QCQDOGSFFXONEO-UHFFFAOYSA-N