ID: 82867
SMILES:CC(C)=CCCC(CCl)=CCc1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.885
CB1 binding score: -14.976
InChIKey:GBTIWTQOOWAGHY-UHFFFAOYSA-N
ID: 82868
SMILES:C(C1CCC(C)CC1Oc1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.705
InChIKey:KMJLOOUXAWGYPP-UHFFFAOYSA-N
ID: 82869
SMILES:C(=O)(C)OCC1=CC2C(CC1)C(C)(C)Oc1cc(C)c(C(O)=O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -13.521
InChIKey:DOPXSNIUKLJVAG-UHFFFAOYSA-N
ID: 82870
SMILES:C(CCCC)c1cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.365
InChIKey:TVLUJXRPTYGDHM-UHFFFAOYSA-N
ID: 82871
SMILES:c1(O)cc(C)cc(OC)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.99
InChIKey:JIAMDLHQCKSETM-UHFFFAOYSA-N
ID: 82872
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(O)C2C3(C)C(C(C=O)(C)CCC3)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.269
InChIKey:ZSNAIGBQJRJRDX-UHFFFAOYSA-N
ID: 82873
SMILES:C1=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 82874
SMILES:c1c(O)c2c(cc1C(C)CO)OC(CCC1C(C)(C)O1)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -14.693
InChIKey:CBCUHARAMSGMNV-UHFFFAOYSA-N
ID: 82875
SMILES:C1C2C(C)(CCC(C)C23Cc2c(O)cc(CCCCC)cc2O3)C(C)(C)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.393
InChIKey:IHAVTSBOBNZSSR-UHFFFAOYSA-N
ID: 82876
SMILES:O=C(OCC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(O)c(C(CC(C)C)=O)c12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.691
InChIKey:XEPJBMGCPAWFJC-UHFFFAOYSA-N
ID: 82877
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.581
InChIKey:WTPLHNOHHJDOPW-UHFFFAOYSA-N
ID: 82878
SMILES:c1(O)c2c(cc(CCC)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: 82879
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.269
InChIKey:IZDCDFGGSRCPGZ-UHFFFAOYSA-N
ID: 82880
SMILES:CC1=CC(c2c(O)ccc(CCCCCC)c2)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -15.519
InChIKey:PVKMWGQCBGMDTA-UHFFFAOYSA-N
ID: 82881
SMILES:c1(O)cc(CCCCC)cc(O)c1C1C=C(C)C(O)CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.208
InChIKey:QDPBPHNHBAJMLV-UHFFFAOYSA-N
ID: 82882
SMILES:Oc1c(C(=C)C)c(-c2c(CCC)oc(C)c2)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -15.118
InChIKey:BSIBDYHKIBZOCX-UHFFFAOYSA-N
ID: 82883
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 82884
SMILES:CC1(C)Oc2c(C)c(OC)cc(C(CC(C)C)=O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -11.723
InChIKey:OWQXSMDESGROHC-UHFFFAOYSA-N
ID: 82885
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 82886
SMILES:C=C(C)C1CCC(CO)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -20.344
InChIKey:ZELUXPWDPVXUEI-UHFFFAOYSA-N
ID: 82887
SMILES:C(c1cc(O)cc(CC=C(C)CCC=C(C)C)c1)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.606
InChIKey:HTEUKVIWVBCTIO-UHFFFAOYSA-N