ID: 27721
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CCC(=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 27722
SMILES:C(C)(=CCCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 27723
SMILES:C12(C(C)C)CCC(C)=CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.928
InChIKey:SMTJUGXKTVNGCI-UHFFFAOYSA-N
ID: 27724
SMILES:c1(CCCCC)cc2c(c(O)c1)CC1(C2(C)CCCC1C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.98
InChIKey:CQRZTGBSGCJYMS-UHFFFAOYSA-N
ID: 27725
SMILES:C(=CC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C(O)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.335
InChIKey:ONDOXPMFFNTWDF-UHFFFAOYSA-N
ID: 27726
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 27727
SMILES:c1(CCCCC)cc2c(c(O)c1C)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.265
InChIKey:IMRYRVANNPGDBT-UHFFFAOYSA-N
ID: 27728
SMILES:CCC(=O)c1c(O)c2c(c3c1C=CC(C)(C)O3)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.429
InChIKey:REYIMVWUNPLMFR-UHFFFAOYSA-N
ID: 27729
SMILES:C(O)(=O)C1=CC2C(C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(CCCCC)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.438
InChIKey:QADBXZGLCQRKPU-UHFFFAOYSA-N
ID: 27730
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)c(OC(=O)CCl)c2)CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.965
CB1 binding score: -13.703
InChIKey:NZOPBFRYSSTZQQ-UHFFFAOYSA-N
ID: 27731
SMILES:C1C(C)=CCCC2(C)Oc3c(c(O)cc(CCCC)c3)C(O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.155
InChIKey:MXVNGDLGXFSDBP-UHFFFAOYSA-N
ID: 27732
SMILES:OC1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 27733
SMILES:C1(C)=CC(c2c(O)cc(CCCC)cc2O)C2C(C)(C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.223
InChIKey:CSCXOJLTBANBQP-UHFFFAOYSA-N
ID: 27734
SMILES:c1(C(=COC)COC(=O)C)c(O)c(C2C(C(=C)C)CC(Cl)C(C)=C2)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.906
CB1 binding score: Not available
InChIKey:ANTRJFTZHCWLNY-UHFFFAOYSA-N
ID: 27735
SMILES:O1c2c(cc(CCCCC)cc2O)C=C(C)CCC=C(C)CCC=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.189
InChIKey:BZBPXYYUSSCONL-UHFFFAOYSA-N
ID: 27736
SMILES:c1(CC=C)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.621
InChIKey:DEZDEPXUXLXPCQ-UHFFFAOYSA-N
ID: 27737
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 27738
SMILES:CC(=O)C1C2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.564
InChIKey:AXGJMPFTNIUXTK-UHFFFAOYSA-N
ID: 27739
SMILES:C(c1c(OC(=O)CCc2ccc(O)cc2)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -14.282
InChIKey:IVIPQNVXDQNONB-UHFFFAOYSA-N
ID: 27740
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 27741
SMILES:c1c(O)c2c(c(O)c1CC=C(C)CCC=C(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.246
InChIKey:AZFQGKDQTQMEFR-UHFFFAOYSA-N