ID: 52312
SMILES:CCCCCCc1cc2c(c(O)c1)C1C3C(C(=O)O1)CCC1C(C)(C)CC(O)C(=C)C13C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -14.817
InChIKey:XRPKGVPPJODZBE-UHFFFAOYSA-N
ID: 52313
SMILES:CCCCCc1cc(O)c(C2C(C(CO)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.483
InChIKey:NOBVLNKOMCEFJL-UHFFFAOYSA-N
ID: 52314
SMILES:C12(Oc3c(C(CC(CC)C)=O)c(O)cc(O)c3C1)CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.411
CB1 binding score: -16.266
InChIKey:WGJCUUPQACLQKD-UHFFFAOYSA-N
ID: 52315
SMILES:Oc1c(C(=O)CC)c(C2C(C(C)(C)O)CCC(C)=C2)c(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.367
InChIKey:HMBAQLWGUBRVPX-UHFFFAOYSA-N
ID: 52316
SMILES:C1C2(C(C)C)Oc3c(ccc(CCCCC)c3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.74
InChIKey:QMYROMZJSQCQDU-UHFFFAOYSA-N
ID: 52317
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(CO)C(O)(C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.485
InChIKey:YIWZZOYXJLEXEF-UHFFFAOYSA-N
ID: 52318
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.624
InChIKey:SFKCWCDDXYSANA-UHFFFAOYSA-N
ID: 52319
SMILES:C1C(C)=CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 52320
SMILES:C=C(C)C1C(c2cc(CCCCC)cc(O)c2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.334
InChIKey:VEBHZTTZGZYZIW-UHFFFAOYSA-N
ID: 52321
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 52322
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C(C(C)C)CCC(O)(C)C2C(=O)CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -9.412
InChIKey:NTAASVGJCSMKKN-UHFFFAOYSA-N
ID: 52323
SMILES:c12c(O)cc(C)cc1OC1(C)CC2C(C(CO)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.291
InChIKey:RTVWXSXYAYYPHF-UHFFFAOYSA-N
ID: 52324
SMILES:C1(Cc2c(O)cc(CCC(OCCCC)=O)cc2O)C2C(C)(CCC1(C)C)C(C)=CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.569
InChIKey:VNOGDPJPJHHMIS-UHFFFAOYSA-N
ID: 52325
SMILES:C=C(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 52326
SMILES:C1C2(C(CO)(C)CCCC2=C)Oc2c(c(O)c(C(OC)=O)c(CCCCC)c2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.061
InChIKey:GRAJLDFYFKVHIF-UHFFFAOYSA-N
ID: 52327
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 52328
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(CO)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 52329
SMILES:C1C(=O)C(C)=C(CCC2(C)Oc3c(c(OC)cc(CCCCCC)c3)C(O)C2)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.345
InChIKey:JUCLIKDLRLWQCR-UHFFFAOYSA-N
ID: 52330
SMILES:CC(C)CC(=O)c1c(O)c2c(cc1OC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.584
InChIKey:GRJKISAVJKILEG-UHFFFAOYSA-N
ID: 52331
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.051
InChIKey:REAKWCAABJGCRO-UHFFFAOYSA-N
ID: 52332
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N