ID: 67726
SMILES:O1c2c(c(O)cc(CCC)c2)C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 67727
SMILES:O=C1C(C)(C)Oc2c(c(O)cc(CCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.294
CB1 binding score: -17.81
InChIKey:YOLADCCFGHOSJP-UHFFFAOYSA-N
ID: 67728
SMILES:C1C(O)C(C)(C)Oc2c(c(O)cc(CCCC)c2)C2C=C(C(=O)OC)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.75
InChIKey:ZXUBEBSZUXISMF-UHFFFAOYSA-N
ID: 67729
SMILES:c1(CCN(C)C)cc(C2C=C(C)CCC2C(C)=C)c(OC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 67730
SMILES:C12=C(c3c(O)cc(CCCCC)cc3OC1C(=O)C(C)C)CC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.941
InChIKey:NQMLMOYMDRFWIS-UHFFFAOYSA-N
ID: 67731
SMILES:c1(CCCCC)cc(O)c2c(c1C=O)OC(C)(C)C1C2(O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.032
InChIKey:AMJCPFGXVKJDKB-UHFFFAOYSA-N
ID: 67732
SMILES:C(C)(C)=CCC1OC1(C1C(c2c(OC)c(CCCCC)cc(O)c2)OC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.733
InChIKey:AWJWWMQXPIKYNO-UHFFFAOYSA-N
ID: 67733
SMILES:Oc1c(O)c(C(=O)OC)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.404
InChIKey:YEFOMQOUXFAWLR-UHFFFAOYSA-N
ID: 67734
SMILES:C1CCC(C)(C)C(Cc2c(O)c(O)cc(CCCCC)c2)C1=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.64
InChIKey:PYJVJTGZDHTTFZ-UHFFFAOYSA-N
ID: 67735
SMILES:CCCCCc1cc2c(c(O)c1C=O)OC1(O)C(CCCC(C)C)(C)OC1CC(C)=CCCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -14.956
InChIKey:ATIDNMVYQKKQBM-UHFFFAOYSA-N
ID: 67736
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 67737
SMILES:C1CCC2(C)CC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -12.543
InChIKey:RMFFSVFJMKUABX-UHFFFAOYSA-N
ID: 67738
SMILES:CC1=CC2c3c(cc(CCCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 67739
SMILES:c1(C(C)NCCc2ccc(O)c(O)c2)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 423.553
CB1 binding score: Not available
InChIKey:UJFXJZIKNKIZKP-UHFFFAOYSA-N
ID: 67740
SMILES:c1(CCCCC)cc(O)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N
ID: 67741
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.779
InChIKey:ZSDJPGLYWNHCIW-UHFFFAOYSA-N
ID: 67742
SMILES:C(CCCCC)Cc1cc(O)c(C2C=C(C(OC3OC(CO)C(O)C(O)C3O)=O)CCC=C(C)C2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.647
CB1 binding score: -14.386
InChIKey:YLZZHYIBSOTKOF-UHFFFAOYSA-N
ID: 67743
SMILES:C(C)(CCc1cc(OC)c(C2C3C(C(C)(C)O3)CCC(C)=C2)c(O)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -16.992
InChIKey:SQTWPFLMXBLBBY-UHFFFAOYSA-N
ID: 67744
SMILES:Oc1c2c(cc(C(C(C)CCCC)C)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.748
InChIKey:BZCYJGGJRXPAAA-UHFFFAOYSA-N
ID: 67745
SMILES:C1(C)=C2C(O)(C(C)(C)Cc3c(cc(CCCCC)cc3O)O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.254
InChIKey:JBNAJNVSERXKEP-UHFFFAOYSA-N
ID: 67746
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.813
InChIKey:CPRQNQKLDJTZEA-UHFFFAOYSA-N