ID: 107017
SMILES:C1(C)=C(CCC(CCCC2(C)Oc3cc(C)cc(O)c3C=C2)C)C(C)C=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.239
InChIKey:WLUZJZHCDCYFDJ-UHFFFAOYSA-N
ID: 107018
SMILES:C(C)(=C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 107019
SMILES:C1(=O)CC2(CCC(C(C)=C)CC2(O)C)Oc2c(c(O)cc(C)c2)C(CC(C)C)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.842
InChIKey:NQDNODSRNNEQKF-UHFFFAOYSA-N
ID: 107020
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 107021
SMILES:Clc1c(O)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.779
CB1 binding score: -16.387
InChIKey:AGVSVRUMLVKNSE-UHFFFAOYSA-N
ID: 107022
SMILES:CC(C)c1c(OC2OC(=O)c3cc(C(O)C(C)C)ccc32)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.639
CB1 binding score: -16.029
InChIKey:GYXDFJYWPDWOOL-UHFFFAOYSA-N
ID: 107023
SMILES:C1(C(C)C)=C(c2c(O)cc(CCCCC)cc2O)C(CC=C(C)C)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.724
InChIKey:ZDGSDUFLCUVNQJ-UHFFFAOYSA-N
ID: 107024
SMILES:COc1c(CCCCC)cc(O)c(C2CC(C(CCC=C(C)C)=C)CCC(C)=CCCC3(C)Oc4c(C)cc(O)cc4C=C32)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 612.895
CB1 binding score: -14.819
InChIKey:XZRTXSIHZZHKTG-UHFFFAOYSA-N
ID: 107025
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 107026
SMILES:C(=O)(C)OC(C)(C)CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.019
InChIKey:VZOORTDTVNNMRX-UHFFFAOYSA-N
ID: 107027
SMILES:C(CC1C2(C)CCC3C(C)(C)Oc4c(c(C)cc(O)c4)C3CC12)=C(C(=O)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -13.493
InChIKey:HDHYQAZANFAHKU-UHFFFAOYSA-N
ID: 107028
SMILES:C(C=C(C)C(OC(CCc1ccccc1)=O)Cc1c(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c(O)c1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -10.287
InChIKey:WATVTTQUYVJCIS-UHFFFAOYSA-N
ID: 107029
SMILES:c1(O)cc(C)c(OC)c2c1C1C(C(C)(C)O2)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.567
InChIKey:CFIANZCTUUDRLM-UHFFFAOYSA-N
ID: 107030
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 107031
SMILES:C1(=O)CC2C(C)(C3Cc4c(cc(SCCC(O)C)nc42)OC3(C)C)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.561
CB1 binding score: -11.842
InChIKey:DITFXSSFKLEGHK-UHFFFAOYSA-N
ID: 107032
SMILES:C(CCCc1cc(O)c2c(c1)OC13C(C(C)(CCC(OC)=O)OC1CC(C)=C)C(=O)C=C2OC(C)(C)C3=O)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.635
CB1 binding score: -12.458
InChIKey:ZVIGEGXOSVDBED-UHFFFAOYSA-N
ID: 107033
SMILES:C1(=C(C)C)CCC2(C)C1Cc1c(ccc(CCCCC)c1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.208
InChIKey:HDKRQKMVTDAYOK-UHFFFAOYSA-N
ID: 107034
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.739
InChIKey:JDCVEMLACZHBME-UHFFFAOYSA-N
ID: 107035
SMILES:C1=C(CO)CC2C(C1)c1c(cc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.879
InChIKey:RCPSALJQRUKESC-UHFFFAOYSA-N
ID: 107036
SMILES:C1(C)(C)C(Oc2cc(O)c(C)c(CCCCC)c2)CC(C2=CCOC2=O)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.214
InChIKey:FNVIUVIJFDECLJ-UHFFFAOYSA-N
ID: 107037
SMILES:CC(C1C2Oc3c(c(O)cc(CCCCC)c3O)CC2(C)CC1)(OC(C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.522
InChIKey:KRHJHSUXJTUCFD-UHFFFAOYSA-N