ID: 54076
SMILES:c1c(C2C(C)C(CC)(O)CC2C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.699
InChIKey:VNYGPFWOMKIUAW-UHFFFAOYSA-N
ID: 54077
SMILES:C1CC(C)(C)C2C(OC)Oc3c(c(OC)cc(CCC(O)CC)c3)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.921
InChIKey:GOIUVGTXXROUDQ-UHFFFAOYSA-N
ID: 54078
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 54079
SMILES:OC(C)(c1oc2c(c(=O)c1-c1c(O)c(O)c(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -14.605
InChIKey:RSUJUOWZYZONRF-UHFFFAOYSA-N
ID: 54080
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CCC(CO)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.894
InChIKey:ORDMCCMHIKUDRI-UHFFFAOYSA-N
ID: 54081
SMILES:C1C2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54082
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 54083
SMILES:c1(CCCC)c2c(cc(C=O)c1O)OC(C)(C)C1C2C=C(CCC=C(C)CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -11.276
InChIKey:LNMGUVDLFJFSCO-UHFFFAOYSA-N
ID: 54084
SMILES:C1(O)C2(C(C)CC=C3C(C)(C)CCCC32C)Oc2cc(CCCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.423
InChIKey:FCJATMWYQZFNQD-UHFFFAOYSA-N
ID: 54085
SMILES:OC(C(C)(C)O)CCC(=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C)CC=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.726
CB1 binding score: -15.29
InChIKey:FZKKHUJZAWEGNE-UHFFFAOYSA-N
ID: 54086
SMILES:C1(C)(C)Oc2cc(O)cc(C)c2C2C1CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.742
InChIKey:BGUXTVZQIBECGN-UHFFFAOYSA-N
ID: 54087
SMILES:C1C(C(=C)C)C(c2c(O)cc(O)c(C=O)c2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.38
InChIKey:NNMCUDWDWIOUNG-UHFFFAOYSA-N
ID: 54088
SMILES:c12c(c(OC)cc(CCCCC)c1)C(=O)C(C(=O)C1C2C(C(=C)C)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -11.405
InChIKey:NLPBBECSFBQCKC-UHFFFAOYSA-N
ID: 54089
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 54090
SMILES:C(C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2)C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.265
InChIKey:YSCAZFSBNIUUGL-UHFFFAOYSA-N
ID: 54091
SMILES:C(=O)(OC1C(COC(C)=O)=CC2c3c(O)cc(C)cc3OC(C)(CCC=C(C)C)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -14.77
InChIKey:ZCWOQMVPLNYJKK-UHFFFAOYSA-N
ID: 54092
SMILES:CC(O)(C)C1OC(=O)c2c(cc(CCCCC)cc2O)SCCC(C)=CC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.544
CB1 binding score: -12.971
InChIKey:VFZQOXNKWDFWLG-UHFFFAOYSA-N
ID: 54093
SMILES:CC1(O)C2C(CC1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.385
InChIKey:XGBLUBYIKPYOCW-UHFFFAOYSA-N
ID: 54094
SMILES:c1c(SC=CC)cc2c(c1)-c1c(cc(CCC(=O)C=CCCCCC)cc1O)OC2CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.616
CB1 binding score: -14.151
InChIKey:MLXZVPDSDAYWQQ-UHFFFAOYSA-N
ID: 54095
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)=C(C)C(C)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.628
InChIKey:SKEFQACENJSCBX-UHFFFAOYSA-N
ID: 54096
SMILES:c1(-c2ccc(O)cc2)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(CCO)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -14.568
InChIKey:ULRQYMWXHVNOIH-UHFFFAOYSA-N