ID: 38725
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 38726
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 38727
SMILES:C(C)(C=CC(C)(C1COc2c(C(=O)C(CC)C)c3c(cc21)OC(C)(C)C1C3CC(C)=CC1)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -16.185
InChIKey:WEZCJIFRKCKZSN-UHFFFAOYSA-N
ID: 38728
SMILES:C1(c2c(O)cc(CCCCC)cc2)C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 38729
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 38730
SMILES:c1(O)c2c(c(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.388
InChIKey:HBNKKKSWEWQCJU-UHFFFAOYSA-N
ID: 38731
SMILES:CC1=CC2c3c(cc(CCCCC)c(O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 38732
SMILES:c1(O)c2c(c(CO)cc1O)C(CC(C)C)=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.81
InChIKey:IAPPGTBRGFFQJO-UHFFFAOYSA-N
ID: 38733
SMILES:COc1cc(CCCCC)cc2c1C1CC(C(=O)O)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.76
InChIKey:UZZRRTREYAHFQN-UHFFFAOYSA-N
ID: 38734
SMILES:C12C(C(C(=C)C)CCC1C)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.825
InChIKey:ZOQOWBOVOPMLPU-UHFFFAOYSA-N
ID: 38735
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)c1ccc(C=O)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -16.078
InChIKey:HFLFHGUEQNTJJY-UHFFFAOYSA-N
ID: 38736
SMILES:C1CC=C(C)C1C1COc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.107
InChIKey:OPVYKNLWLYSXGP-UHFFFAOYSA-N
ID: 38737
SMILES:C1C=C(C)C=CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.787
InChIKey:SWYPVRSRVHMVEW-UHFFFAOYSA-N
ID: 38738
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 38739
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C=C(C)C(OC(C)=O)CC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.619
InChIKey:CFBAWZYJHVMPNR-UHFFFAOYSA-N
ID: 38740
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 38741
SMILES:C(C)CCc1cc(O)c2c(c1)OC1(C)C(C2)C(C)(C)C(O)C(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.993
InChIKey:HMABCSWLKNJSRH-UHFFFAOYSA-N
ID: 38742
SMILES:C(CC)CC(=O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.567
InChIKey:DPPKYHOTMNVBHC-UHFFFAOYSA-N
ID: 38743
SMILES:C1=C(C)C(OC(C)=O)C(C=C(C)CCC=C(C)C)CC(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -16.29
InChIKey:ZXHMGLQEUZOZHC-UHFFFAOYSA-N
ID: 38744
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(C(=O)CC(C)C)c(C=O)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.951
InChIKey:JCUCPOOZMFTAAQ-UHFFFAOYSA-N
ID: 38745
SMILES:C(C)(=NOC(=O)C1CCC(C)=CC1c1cc(CCCCC)ccc1O)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 419.565
CB1 binding score: -14.905
InChIKey:NTEFDMYVSFABHD-UHFFFAOYSA-N