ID: 94375
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94376
SMILES:Oc1cc(-c2c(O)cc(CCCCC)cc2O)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -14.885
InChIKey:VZHNBXVAJBQLOZ-UHFFFAOYSA-N
ID: 94377
SMILES:C(C)(=CCC1(C)CCCC23C(c4c(O)ccc(O)c41)OC3C(C(C)=C)C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.367
InChIKey:QSUHDIDELDXFQI-UHFFFAOYSA-N
ID: 94378
SMILES:C(=O)(C=C(C)C)C1=C(C)C(c2c(O)cc(CCCCC)cc2)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.536
InChIKey:XSQPUIAYBLGDOX-UHFFFAOYSA-N
ID: 94379
SMILES:C=C(C1CCc2c(cc(CCCCC)cc2O)O1)C(=O)C=CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -18.773
InChIKey:IOADBGHPHCMWMN-UHFFFAOYSA-N
ID: 94380
SMILES:c1(CCCCCC)c(C)cc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -17.965
InChIKey:OLZZBCBMOAKKLA-UHFFFAOYSA-N
ID: 94381
SMILES:C(=CCCCCC(c1c(O)c2c(cc1C)OC(C)(C)C1CC=C(C)CC21)C)=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.62
InChIKey:VGAWNMBHBLHGSD-UHFFFAOYSA-N
ID: 94382
SMILES:Oc1cc(CCC)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.978
InChIKey:ZCVYXVHFOBOOMS-UHFFFAOYSA-N
ID: 94383
SMILES:C1(O)CC(C(C)C)C(C=C(C)C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.438
InChIKey:CSTJWGNUJBREQM-UHFFFAOYSA-N
ID: 94384
SMILES:Oc1c(C(C(C)=C)CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.478
InChIKey:NBGXCDPPEOAQJF-UHFFFAOYSA-N
ID: 94385
SMILES:C1(c2ccccc2)C2C(=C(C)C1=O)OC(C)(C)C(CCC(C)=CCc1c(OC)c(C)cc(OC)c1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.695
CB1 binding score: -16.502
InChIKey:KCOOAUGENWLVTE-UHFFFAOYSA-N
ID: 94386
SMILES:C1CC12C(C)(C)Oc1c(c(O)cc(CCC)c1)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.826
InChIKey:VVFDOFJAEWFQFY-UHFFFAOYSA-N
ID: 94387
SMILES:CC1CCC2C(C(O)O1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -0.924
InChIKey:FWFQLTPNLYDMOP-UHFFFAOYSA-N
ID: 94388
SMILES:CC1(C)C2CC=C(C)CC2c2c(c(O)cc(C)c2O)-c2c(O)ccc(CCC(CO)OC)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -17.529
InChIKey:KRYVPEVVSPXCRM-UHFFFAOYSA-N
ID: 94389
SMILES:COc1cc(CCC=C(C)C)cc(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -15.174
InChIKey:QAWCJIOUSMCYAM-UHFFFAOYSA-N
ID: 94390
SMILES:C(CC(C)=CCc1c(O)ccc(O)c1)C=C(C1OC(C)(C)C(O)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.899
InChIKey:KOVQTNBQOUAFIS-UHFFFAOYSA-N
ID: 94391
SMILES:COC(Cc1c(O)c2c(cc1C(=O)O)OC(C)(C)C1CCC(C)=CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -17.527
InChIKey:IJHSQJGMLLHDIB-UHFFFAOYSA-N
ID: 94392
SMILES:C(=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C(O)=O)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.015
InChIKey:YGCOGLGDHRYFML-UHFFFAOYSA-N
ID: 94393
SMILES:CC(=CCCC(C)CCCC(C)=CCc1c(O)cc(C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N
ID: 94394
SMILES:CC(O)(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC2C(O)C(O)C(O)CO2)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.555
CB1 binding score: -15.02
InChIKey:AILXFBDFUFYKOB-UHFFFAOYSA-N
ID: 94395
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N