ID: 33097
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C(=C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.334
InChIKey:KKGGNLGHOSMNOH-UHFFFAOYSA-N
ID: 33098
SMILES:C1CC(C(C)CO)C(c2cc(CCCCC)ccc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.597
InChIKey:PQSXNTYRZWZXFA-UHFFFAOYSA-N
ID: 33099
SMILES:C(=C)CC1(C)Oc2c(c(OC(=O)C)cc(CCC)c2)C(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.434
InChIKey:FCGWSAVRNLMIOJ-UHFFFAOYSA-N
ID: 33100
SMILES:C12(C)CCC(C(C)C)(Oc3c(c(O)cc(CCCCC)c3)C1=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.223
InChIKey:SPQMSJSSQFGEEH-UHFFFAOYSA-N
ID: 33101
SMILES:C(C)C(C(=C)C(C(=O)c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1)C)(O)C(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -16.492
InChIKey:BNBIHHJUVMMQCT-UHFFFAOYSA-N
ID: 33102
SMILES:Cc1ccc2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 33103
SMILES:O=C(CC(C)C)OCC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.398
InChIKey:AIAHDFOEMMDWSR-UHFFFAOYSA-N
ID: 33104
SMILES:CC(C)CC(c1c(O)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.591
InChIKey:DIWOAJBMTCMIGY-UHFFFAOYSA-N
ID: 33105
SMILES:C(CCCc1cc(O)c2c(c1O)C=CC(C)(CCC=C(C)C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.288
InChIKey:FKOZPAYXTBOMJM-UHFFFAOYSA-N
ID: 33106
SMILES:C1(O)C2(C(C)C)Oc3c(c(OC)cc(CCC)c3)C1C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.136
InChIKey:QGLVKKOYKQEXQN-UHFFFAOYSA-N
ID: 33107
SMILES:CC12CCCC3(C(=O)O)C1C(c1c(cc(CCCCC)cc1O)OC2)OC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.286
InChIKey:LPDVTSZSPKXMQQ-UHFFFAOYSA-N
ID: 33108
SMILES:C(C)CCCc1cc2c(cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.649
InChIKey:CBFJCKSFJPWQQA-UHFFFAOYSA-N
ID: 33109
SMILES:CC1=CC2C(C(=O)CC1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.74
InChIKey:BUUBIDNFGRCKKI-UHFFFAOYSA-N
ID: 33110
SMILES:c12c(c(OC)cc(CCCCC)c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.808
InChIKey:YNZCDBUYFIPVPH-UHFFFAOYSA-N
ID: 33111
SMILES:C=C(C1CCC(C)CC1c1c(O)cc(CCCCCO)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.302
InChIKey:AJOLOGUUIFVLJS-UHFFFAOYSA-N
ID: 33112
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1C(C)(CCC=C(C)CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.281
InChIKey:RWUOBUFDUNCEBX-UHFFFAOYSA-N
ID: 33113
SMILES:C(CCCCCC)CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.457
InChIKey:CWXKITARQPOZNY-UHFFFAOYSA-N
ID: 33114
SMILES:C1C(Br)C(O)(C)C2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.353
CB1 binding score: -16.254
InChIKey:DUJSXBUZQSLDKW-UHFFFAOYSA-N
ID: 33115
SMILES:C12(O)C(C(C)CC1)Cc1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.178
InChIKey:HPELXFGZUONRJA-UHFFFAOYSA-N
ID: 33116
SMILES:CCCc1cc2c(cc1O)OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.621
InChIKey:NISJRGSMVIAMQA-UHFFFAOYSA-N
ID: 33117
SMILES:c1(CCC(CCCC(C=C)C)C)c(C=O)c(O)c2c(c1)OC1(C)C(C2)C(O)(CC)CCC1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.775
CB1 binding score: -15.111
InChIKey:GMBWJQXWGHDIOD-UHFFFAOYSA-N