ID: 58129
SMILES:c1(OC)cc(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.987
InChIKey:WEJIEIZJRLUNOB-UHFFFAOYSA-N
ID: 58130
SMILES:C1(=O)C(C)CC2C(C(C)(C)Oc3c2ccc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.213
InChIKey:FFYCRQFJUKPFIA-UHFFFAOYSA-N
ID: 58131
SMILES:O1C(CCCC(C)(O)C)(C)C2CC3C4(C2(C)C1)Cc1c(cc(O)cc1C)OC43O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.448
InChIKey:SSYQRMOPYJTAMW-UHFFFAOYSA-N
ID: 58132
SMILES:c1c(CCCCC)cc2c(c1O)C1CC(C=C)(C)C(C(C=O)=C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.609
InChIKey:DROMLMYRIQZMRU-UHFFFAOYSA-N
ID: 58133
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2CC3(C)C(O)(CCC12)C(C)=CC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -12.935
InChIKey:HJMZKMMGQUCSJV-UHFFFAOYSA-N
ID: 58134
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C=CC(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 58135
SMILES:Oc1c(C(O)=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 58136
SMILES:c12c(c(C(=O)c3ccccc3)c(O)c(CC3=CCC=C(C)C3(CC=C(C)C)O)c1O)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.727
CB1 binding score: -16.154
InChIKey:CDIXTOPHXVUETC-UHFFFAOYSA-N
ID: 58137
SMILES:C12C(C)(CCCC1(C)C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 58138
SMILES:C1(Cl)=C(C)C2(c3c(O)cc(CCCCC)cc3O1)C(C)C=C(C)C2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 415.017
CB1 binding score: -16.078
InChIKey:XXYYLDYLLDQKHJ-UHFFFAOYSA-N
ID: 58139
SMILES:C(CCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C1C2=C(O)C(O)=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -15.388
InChIKey:AMHNCIPGLPSWAC-UHFFFAOYSA-N
ID: 58140
SMILES:C1CCC(C)CCC2C3(C)Oc4c(c(O)cc(CCCCC)c4)C13CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -12.094
InChIKey:FJNVSAXCIQUFOK-UHFFFAOYSA-N
ID: 58141
SMILES:CCC(OC(C)=O)C1=CC2C(CC1)C(C)(C)Oc1c2c(=O)oc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.398
InChIKey:RCYOEGMXENSLLM-UHFFFAOYSA-N
ID: 58142
SMILES:CC(C)=C1CCC(C)CC1c1c(O)cc(CC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.015
InChIKey:HYCFIAGOTJPUIR-UHFFFAOYSA-N
ID: 58143
SMILES:C(CC)Cc1cc(O)c2c(c1)-c1c(cccc1O)C(COC(CC1(C)C(C=C)CCC1(C)C)=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -15.705
InChIKey:LHBSTTJHSHJCDT-UHFFFAOYSA-N
ID: 58144
SMILES:CC1(O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C1C(O)C3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.702
InChIKey:GVRLBUUGSJSNEI-UHFFFAOYSA-N
ID: 58145
SMILES:c12cc(CCCCC)cc(O)c1C1C(C)(C)C(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -12.364
InChIKey:JCHDXUQTDKCVFQ-UHFFFAOYSA-N
ID: 58146
SMILES:Oc1c2c(c(CO)c(O)c1C=CC(CCC=C(C)C)(C)O)OC(C)(C)C1CCC(C)(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.717
InChIKey:JQNSYGLVDZLFBU-UHFFFAOYSA-N
ID: 58147
SMILES:C1(O)C(C)=CC2c3c(O)cc(CCC)cc3OC(C)(CC1)C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.549
InChIKey:RDZBEOSSYWKZOF-UHFFFAOYSA-N
ID: 58148
SMILES:C(c1cc(C2C=C(C)CCC2C(C)=C)c(O)c2c1OC(C)(CCC=C(C)C)C(O)CC2)(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -16.388
InChIKey:VTTMWXFAGYEJHT-UHFFFAOYSA-N
ID: 58149
SMILES:c12c(ccc(CCCCC)c1)OC(C1(C)CCC(C)=CC1O)CC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: Not available
InChIKey:NLRDCXLVCFSXDP-UHFFFAOYSA-N