ID: 12097
SMILES:CC(C1OC(C)(C(OC(=O)C)CCC(C)=CCc2c(O)c(C)cc(OC)c2)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -15.94
InChIKey:UKIVPWZTPGLSMM-UHFFFAOYSA-N
ID: 12098
SMILES:C1(C)=CCCC(O)(C)C2C3C1c1c(cc(CCCCC)cc1O)OC(C)(C)C3CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.807
InChIKey:UXAVWHHGKWGNLJ-UHFFFAOYSA-N
ID: 12099
SMILES:C(CC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)C=C(C)CC=CC(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -16.769
InChIKey:CTRFKZWBYAYMAC-UHFFFAOYSA-N
ID: 12100
SMILES:C1(C(=C)C)CC=C(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 12101
SMILES:C12(O)C(c3c(O)c(C(O)=O)c(CCCCC)cc3O1)CC(C)C1OC1(C(C)C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -15.103
InChIKey:QEFIYXFCWXUTNZ-UHFFFAOYSA-N
ID: 12102
SMILES:Oc1c(O)cc(Cc2cc(O)c(C3C(=C)CCC(C)(C)C3)c(CCCCC)c2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.328
InChIKey:YJLRLFYTMSRZPJ-UHFFFAOYSA-N
ID: 12103
SMILES:CC1(C)C2(C(C)=CCC1)Cc1c(cc(C)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.432
InChIKey:PSSYQGUNSICNMZ-UHFFFAOYSA-N
ID: 12104
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.79
InChIKey:XQKKQKVZTUMWGM-UHFFFAOYSA-N
ID: 12105
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1OC=C(C(O)O)C(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.966
InChIKey:YFXBPORLDMMHMT-UHFFFAOYSA-N
ID: 12106
SMILES:c1c(C2C(CCC=C(C)C)(C)O2)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -12.69
InChIKey:CWLIKMGXUQMXFZ-UHFFFAOYSA-N
ID: 12107
SMILES:C1=C2c3c(c(CC=C(C)C)c(CCCCC)cc3O)OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.638
InChIKey:YLWQHHXJDPKYHT-UHFFFAOYSA-N
ID: 12108
SMILES:O=C(OCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.124
InChIKey:PEVAQAZBLFGCGT-UHFFFAOYSA-N
ID: 12109
SMILES:C1(=COC(=O)C)CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.262
InChIKey:RYNJXNKWRAOYOD-UHFFFAOYSA-N
ID: 12110
SMILES:Cc1cc2c(c(O)c1)C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 12111
SMILES:COc1c2c(cc(CCCC)c1)OC(C)(C)C1CC=C(C)C(O)CC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: Not available
InChIKey:PBWCULCCNFUTNL-UHFFFAOYSA-N
ID: 12112
SMILES:C(C(C)(C)C)CCC(C)=CCc1c(OC)c2c(cc1O)OC1(C)C3C2OC(C1)C3(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.111
InChIKey:VVQMWJPCWSJJRH-UHFFFAOYSA-N
ID: 12113
SMILES:C=C(C1C(C)(C)C2C(O)(c3c(cc(CCCCC)cc3O)O1)CC2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.288
InChIKey:PUNMDSZPYICEJJ-UHFFFAOYSA-N
ID: 12114
SMILES:c12c(O)cc(CCCCC)c(C(=O)O)c1OC(C)(C)C1Cc3c(c(CC=C(C)CCC=C(C)C)ccc3O)c(CC=C(C)C)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 628.85
CB1 binding score: -15.73
InChIKey:QBUHDJAHQDGEGX-UHFFFAOYSA-N
ID: 12115
SMILES:CC1(C)Oc2c(c(O)cc(CCc3c(O)c(CC=C(C)C)c(O)cc3CCC=C(C)C)c2)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.512
InChIKey:WGAKBKLDFPNQGK-UHFFFAOYSA-N
ID: 12116
SMILES:C(Oc1c(O)c(C(=O)OC)cc(CCCCC)c1)C1=C(C)CC(C)(C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.665
InChIKey:PTEWUPIUNSMREB-UHFFFAOYSA-N
ID: 12117
SMILES:Oc1c(C(=O)CC(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.732
InChIKey:YTUOYCBFPFMSNW-UHFFFAOYSA-N