ID: 42379
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42380
SMILES:Oc1c(C2C=C(C)C(C)CC2C=C(CC2C(C)(C)O2)C)c(O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.843
InChIKey:MAYIWOXOWMLOLD-UHFFFAOYSA-N
ID: 42381
SMILES:C12c3c(cc(CCCCC)cc3OC)OC3C(C(C)C)CCC(C)(C=C(C)C1O)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.81
InChIKey:LIBSDVCQHDEVRL-UHFFFAOYSA-N
ID: 42382
SMILES:COc1c2c(c(O)c(C)c1)C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.861
InChIKey:JXLJHPPCQBSSCZ-UHFFFAOYSA-N
ID: 42383
SMILES:c1(CC(C)C)cc(O)c2c(c1)OC(C)(C)c1c2cc(C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.805
InChIKey:AFDYOVCCXDOCIA-UHFFFAOYSA-N
ID: 42384
SMILES:C1C2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(O)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.439
InChIKey:PSAZIEKZDHQAEG-UHFFFAOYSA-N
ID: 42385
SMILES:C1(C)(C)C2(c3c(OC(=O)C)cc(CCCCC)cc3O1)CC(C(O)(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.008
InChIKey:QZUWYIFDQKHNIT-UHFFFAOYSA-N
ID: 42386
SMILES:c1(-c2c(O)cc(CCCCC)cc2O)c(O)c(CC=C(C)C)c(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -15.171
InChIKey:SBIOMYCLUJPKNQ-UHFFFAOYSA-N
ID: 42387
SMILES:C12C=C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(OS(=O)(O)=O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.533
CB1 binding score: -17.882
InChIKey:GWGSCCUEHBBLTG-UHFFFAOYSA-N
ID: 42388
SMILES:c1cc2c(c(-c3c(O)cc(CCCCC)cc3O)c1)OC(C)(C)C1CCC(C)(O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.344
InChIKey:WFZPBVNSVHEHAP-UHFFFAOYSA-N
ID: 42389
SMILES:C1(C)=CC2Oc3c(c(OC(C)=O)cc(CCCCC)c3)C3C(C)(C)C3C2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.554
InChIKey:RQINAESTFKNLFP-UHFFFAOYSA-N
ID: 42390
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 42391
SMILES:O=C(C)C1(O)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.783
InChIKey:FCMIQEGGHHUAAS-UHFFFAOYSA-N
ID: 42392
SMILES:C(COc1cc(CCCCC)cc(OC)c1)=C(C)CCC=C(CC(O)C=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -14.284
InChIKey:ZRRVWHCTIRUSCE-UHFFFAOYSA-N
ID: 42393
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -18.531
InChIKey:QHXOCZYXQWUAQM-UHFFFAOYSA-N
ID: 42394
SMILES:c1(-c2ccccc2)c(CC2C(C)=CCC3C(C)(C)C4(O)OCC23C4)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 594.836
CB1 binding score: -15.822
InChIKey:RVXVKHNMXUMFDU-UHFFFAOYSA-N
ID: 42395
SMILES:C(CCCc1cc2c(c(O)c1)C(=O)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.735
InChIKey:FZQJMWDXFIWHON-UHFFFAOYSA-N
ID: 42396
SMILES:O1c2c(cc(CCCCC)cc2O)C2CCC(C)=CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.621
InChIKey:ZUFLCSVLUSOBPO-UHFFFAOYSA-N
ID: 42397
SMILES:Oc1c(CCCCC)cc(OC)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.475
InChIKey:ROUJURXKELQUPW-UHFFFAOYSA-N
ID: 42398
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)C)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.81
InChIKey:KVDBNLOKWYLSLD-UHFFFAOYSA-N
ID: 42399
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N