ID: 47671
SMILES:c1(O)ccc(OCCCC)c2c1C1(O)C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.349
InChIKey:FJZSHEQGKPHNJR-UHFFFAOYSA-N
ID: 47672
SMILES:C1(C)(C)C2=C(c3c(cc(CCCCC)cc3O)O1)CC(C)=CC2C(O)Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -15.655
InChIKey:OFZPYHRKZFBEJE-UHFFFAOYSA-N
ID: 47673
SMILES:C(C(CC(c1c(O)cc(O)cc1CCCCC)=O)C(O)=O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.105
InChIKey:UYMOSDICGTUSCG-UHFFFAOYSA-N
ID: 47674
SMILES:c1(C=O)c2c(c(O)c(C(O)CC(C)C)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.956
InChIKey:WYODQPLIJQKVBX-UHFFFAOYSA-N
ID: 47675
SMILES:O1C(CO)C(O)C(O)C(O)C1Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(COC2C(O)C(O)C(O)CO2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 626.74
CB1 binding score: -15.929
InChIKey:MWMGYACADAIWIM-UHFFFAOYSA-N
ID: 47676
SMILES:C1C2C(C)(CCC=C(CO)C)CCCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.535
InChIKey:AFVOGKOJYITIML-UHFFFAOYSA-N
ID: 47677
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 47678
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 47679
SMILES:C(C(O)(C)C)(Cc1c(C(=O)C(C)C)cc2c(c1O)C1CC(C)=CCC1C(C)(C)O2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.836
InChIKey:UHAILHKCLNAEAM-UHFFFAOYSA-N
ID: 47680
SMILES:CC1(C)Oc2c(c(O)c(C(C)CCCCC)cc2O)C2CC1CCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.364
InChIKey:KSLOQXBENMTMOK-UHFFFAOYSA-N
ID: 47681
SMILES:C1=C(C)C(O)CC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.238
InChIKey:QNATXLRIBKPNMJ-UHFFFAOYSA-N
ID: 47682
SMILES:c1(CC=O)cc(C(O)=O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -15.698
InChIKey:MHZINYKVQJDLMM-UHFFFAOYSA-N
ID: 47683
SMILES:c1cc(CCCC)c(O)c2c1OC(C)(C)C1C(CC(C)=CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.715
InChIKey:MLQGVEXRNXJNEF-UHFFFAOYSA-N
ID: 47684
SMILES:c12c(cc(CC)cc1O)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -18.604
InChIKey:MGMRFJXQQCBBTE-UHFFFAOYSA-N
ID: 47685
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 47686
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2)(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -16.502
InChIKey:YPSLEGGDIZROPX-UHFFFAOYSA-N
ID: 47687
SMILES:C(C)1(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: 47688
SMILES:C(O)(CC=C(Cc1cc(C2C(C(=C)C)CCC(C)=C2)c(O)cc1)F)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.47
CB1 binding score: -17.163
InChIKey:JUJBYEHILSDTQX-UHFFFAOYSA-N
ID: 47689
SMILES:c1(CCO)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -18.479
InChIKey:MDEPVPRUIJGWJK-UHFFFAOYSA-N
ID: 47690
SMILES:O(C)c1c(CCCC)cc(O)c2c1C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.832
InChIKey:GLRLLGQWALUQHF-UHFFFAOYSA-N
ID: 47691
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(C)c3c1C(=O)C(C)=C(O)C2=N3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.525
CB1 binding score: -14.144
InChIKey:MEYJGEVUAMPRDH-UHFFFAOYSA-N