ID: 122578
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.652
InChIKey:GFZBDSMMEKEACG-UHFFFAOYSA-N
ID: 122579
SMILES:C1(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.05
InChIKey:JFZZYHKUDISIPQ-UHFFFAOYSA-N
ID: 122580
SMILES:C(=C(C)C)CCC(=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 122581
SMILES:O=C(C(C)C)CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.123
InChIKey:XGMIVEMXNWECGR-UHFFFAOYSA-N
ID: 122582
SMILES:CC(C)=CCc1c(OC)cc(CCCCC)cc1OC1OCC(O)C(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -16.48
InChIKey:ULXVUBFOGQAPPQ-UHFFFAOYSA-N
ID: 122583
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCC)c3)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 122584
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(C(C)C)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.069
InChIKey:WYUZQDOKUVLEIC-UHFFFAOYSA-N
ID: 122585
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(CCC3C(C)(CCC(O)C3(C)C)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15.116
InChIKey:CKRWAPGFCLOILQ-UHFFFAOYSA-N
ID: 122586
SMILES:COc1c2c3c(c(OC(=O)CCC)c1)OC(C)(C)C(CCC1(C)Oc4cc(C)c(O)cc4CC1)CC23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -14.251
InChIKey:YNQQEQYHCKGTGW-UHFFFAOYSA-N
ID: 122587
SMILES:CC(C)c1cc(O)c2c(c1)OC(C)(C)C1C2CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -20.32
InChIKey:RVLBYEUCGVTUQF-UHFFFAOYSA-N
ID: 122588
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCCO)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.321
InChIKey:TZDMZIQEUUZTPA-UHFFFAOYSA-N
ID: 122589
SMILES:CC1(C)C2(C[CH]C(C)=CC2)c2c(cc(CCC)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 285.407
CB1 binding score: -16.693
InChIKey:SBHZGGXTQQPELY-UHFFFAOYSA-N
ID: 122590
SMILES:c1(C=CC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.329
InChIKey:UXMYALNHHLVVAU-UHFFFAOYSA-N
ID: 122591
SMILES:C(C(C1(OC(C)(C)C)CC=C(C)CC1)=C)c1cc(OC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.436
InChIKey:TXNLGROFQNKFDX-UHFFFAOYSA-N
ID: 122592
SMILES:C1CC2C(C1C(C)=C)C(C)Oc1c2c(O)cc(C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 286.415
CB1 binding score: -11.795
InChIKey:NBKBYODDDVDLBT-UHFFFAOYSA-N
ID: 122593
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 122594
SMILES:Cc1cc(C2C(C(=C)C)CCC(C)=C2)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.706
InChIKey:FBXSVXARSUKKDJ-UHFFFAOYSA-N
ID: 122595
SMILES:C1(C(C)C)C(c2c(O)cc(CCCC(O)C)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:FKYCESMPECTWJB-UHFFFAOYSA-N
ID: 122596
SMILES:C(OC)CC1(C)C(C(=C)C)CCC(C)=CC1c1c(O)cc(CC(C)C)oc1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.47
InChIKey:BHRUOFRLLKUIMJ-UHFFFAOYSA-N
ID: 122597
SMILES:C1CC(C(C)=C)C(c2c(O)cc(O)c(O)c2)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.204
InChIKey:MCOHBLINZXMLKV-UHFFFAOYSA-N
ID: 122598
SMILES:CC(Cc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.704
InChIKey:YFDSXXRISTZPSW-UHFFFAOYSA-N