ID: 93850
SMILES:C=C(C)C1CCC2(C)C1CCC(C)=CCc1c(O)cc(C)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.075
InChIKey:YEMMDSYBQOFHEA-UHFFFAOYSA-N
ID: 93851
SMILES:O=C(C)Oc1c2c(cc(C)c1)C(C(CCCC(C)C)(C)O)CCC2C(=O)OC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -16.785
InChIKey:GAKANHGGWWOBMX-UHFFFAOYSA-N
ID: 93852
SMILES:CC1(C)C2C3C(c4c(cc(CCCCC)cc4O)OC2O1)CCC=C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.688
InChIKey:DOFGGSLMKVPSCS-UHFFFAOYSA-N
ID: 93853
SMILES:CC(C)=CCOc1ccc(O)cc1-c1cc(CCCCC)cc2c1CC1C(C)(O2)C2CCC(C)=CC2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.695
CB1 binding score: -16.078
InChIKey:OXAUYKXROVEIBS-UHFFFAOYSA-N
ID: 93854
SMILES:c1(OCOCC)c(CCCCC)cc2c(c1O)C1CC(C)(O2)CCC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.563
CB1 binding score: -15.488
InChIKey:FRQCZLRXXRRMHL-UHFFFAOYSA-N
ID: 93855
SMILES:CC1(C)CCCC(C)=C1C=CC(=CCc1c(O)cc(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.798
InChIKey:JFVFKNVKEJDCNV-UHFFFAOYSA-N
ID: 93856
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 93857
SMILES:c1c(CC(=O)O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.284
InChIKey:JFYHTQKMNGWLCU-UHFFFAOYSA-N
ID: 93858
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.834
InChIKey:XPLQNXRZESLCTJ-UHFFFAOYSA-N
ID: 93859
SMILES:C12C(C(CC(C)=O)(C)Oc3c1ccc(CCCCC)c3)OC(=O)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.181
InChIKey:VXLAWZDIMKJPLU-UHFFFAOYSA-N
ID: 93860
SMILES:CC(OCC1=CC2c3c4c(c(O)c(C(=O)C(C)C)c3O)OC(C)(C)C4CC=C(C)C2CC1CC=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -17.088
InChIKey:DKMCETUZNVVLKJ-UHFFFAOYSA-N
ID: 93861
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2OC2(C)CCC2C(C)(CC=C1C)CC(=O)C(O)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -17.127
InChIKey:OLUYPYYQUNHGHD-UHFFFAOYSA-N
ID: 93862
SMILES:CC1(C)C=Cc2c(cc(CCCC)c(CCCCC)c2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.388
InChIKey:BIBSIAKYSAAALC-UHFFFAOYSA-N
ID: 93863
SMILES:C1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(OO)C)C(O)CC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.022
InChIKey:XBXHUIALDSAAAV-UHFFFAOYSA-N
ID: 93864
SMILES:c1(C=O)c(CCCCC)cc(O)c2c1OC1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.769
InChIKey:ZJUGISHLWZWGHJ-UHFFFAOYSA-N
ID: 93865
SMILES:CC(C)=CCCC(C)=CC1Oc2c(c(O)cc(CCCCC)c2)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.405
InChIKey:YXQXMUAKTWOTBN-UHFFFAOYSA-N
ID: 93866
SMILES:C=C(C)C1C(c2c(O)cccc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 93867
SMILES:C1=C(C)COc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -17.881
InChIKey:HZTBOQLZTCDDEK-UHFFFAOYSA-N
ID: 93868
SMILES:CC(C1C(O)C=C(C)CC1c1c(O)cc(CCCCCO)cc1OC)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.2
InChIKey:QHSMDLHFYOQFRS-UHFFFAOYSA-N
ID: 93869
SMILES:c12c(C(=O)OC)c(CCCCC)cc(O)c1C1(C(C(C)C)=CC(C)CC1C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.285
InChIKey:SPVKIOAXAADUMM-UHFFFAOYSA-N
ID: 93870
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