ID: 89293
SMILES:C1=C(C(O)=O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 89294
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3OC(=O)C(=C)C321
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.358
InChIKey:AIJXOWOQBJWBIU-UHFFFAOYSA-N
ID: 89295
SMILES:C(CC=C(C)C)C1(C)CC(=O)c2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.334
InChIKey:WINCRFZOLLUXNL-UHFFFAOYSA-N
ID: 89296
SMILES:c1c(CCCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 89297
SMILES:Oc1cc(CCCC)cc2c1C1C(C(C)(C)O2)CC(CC=C(C)C)C(C)(C)C2OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.395
InChIKey:MKUDSEWUFFVUCW-UHFFFAOYSA-N
ID: 89298
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(O)C(C)C3=C(COC3(C)C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.383
InChIKey:QRARYSSBGAFFMV-UHFFFAOYSA-N
ID: 89299
SMILES:C(Oc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc12)(CC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -15.749
InChIKey:TUIKEKJHVACVJE-UHFFFAOYSA-N
ID: 89300
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(OC(C)=O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.697
InChIKey:NWHMAUOECOGBFN-UHFFFAOYSA-N
ID: 89301
SMILES:C1CC(C)=CCC2C(C)(C)Oc3cc(CCCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.8
InChIKey:WHLHCZFQSZUYJA-UHFFFAOYSA-N
ID: 89302
SMILES:C1(O)C(C)(C)C2C3(c4c(c(C(=O)O)c(CCCCC)cc4O)OC3CC2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.652
InChIKey:BSBQBVXDWGYWQF-UHFFFAOYSA-N
ID: 89303
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)cc(O)cc1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -17.323
InChIKey:RWYJOVKLEWZJKJ-UHFFFAOYSA-N
ID: 89304
SMILES:c1(C(=O)O)c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(O)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.015
InChIKey:MUXSINOGCIKQCX-UHFFFAOYSA-N
ID: 89305
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C(C)(C=CC=C(C)C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.616
CB1 binding score: -12.335
InChIKey:GDSFILRBEJYIJB-UHFFFAOYSA-N
ID: 89306
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.677
InChIKey:KOVIXEDIXZAYDD-UHFFFAOYSA-N
ID: 89307
SMILES:c12c(c(=O)cc(CCC)cc1O)OC(C)(C)C1CCC(COC(C(C)C)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.553
InChIKey:IYNHJOBKKIHBLF-UHFFFAOYSA-N
ID: 89308
SMILES:OC(C1Oc2c(cc(CCCCC)cc2O)C=C(C)CCC=C(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.438
InChIKey:OFKIPKNRJMSBIZ-UHFFFAOYSA-N
ID: 89309
SMILES:C1(C)(C)Oc2cc(CCC)cc(O)c2C2CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.245
InChIKey:LEPQXXZYOXFDSW-UHFFFAOYSA-N
ID: 89310
SMILES:C=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 89311
SMILES:CC12CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3C1C(C)CC=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.258
InChIKey:OMQNJCKHHACCAG-UHFFFAOYSA-N
ID: 89312
SMILES:C1Oc2c(c3c(c(O)c2CCCCC)OC(C)(C)C2C3CC(C)CC2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.994
InChIKey:IDFQZUVHRXMENM-UHFFFAOYSA-N
ID: 89313
SMILES:CC(C1=CC=C(C)CC1c1c(O)cc(CCCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.364
InChIKey:ZTOLBQMOVCPOSF-UHFFFAOYSA-N