ID: 89104
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 89105
SMILES:Cc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.913
InChIKey:USHZBDBBZHEKPJ-UHFFFAOYSA-N
ID: 89106
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 89107
SMILES:C(C)(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.701
InChIKey:DMZBTZFODZYIFX-UHFFFAOYSA-N
ID: 89108
SMILES:c1(C(O)=O)c(CO)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -14.798
InChIKey:HKRKRKSQFSIIRW-UHFFFAOYSA-N
ID: 89109
SMILES:O1C(C)(C)C1Cc1c(O)c(O)c2c(c1O)C1Oc3c(CC=C(C)C)c(O)c(CCCO)cc3OC(C)(C)C1CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.68
CB1 binding score: -13.848
InChIKey:KKSLRJLHGXITSY-UHFFFAOYSA-N
ID: 89110
SMILES:c1(C(CC)C)c(O)c(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.103
InChIKey:PKSBUFRYUFABGX-UHFFFAOYSA-N
ID: 89111
SMILES:Oc1c2c(cc(CCCCC)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 89112
SMILES:O=C(Cc1cc2c3c(c1)OC1(C)CC3C(C1)C(C)(C)O2)C1CCC(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 370.489
CB1 binding score: -15.12
InChIKey:JQYYUVMMFOGDNG-UHFFFAOYSA-N
ID: 89113
SMILES:C1CC(C)C2(Oc3cc(C(CCCCCC)C)cc(O)c3C2)C2CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.915
InChIKey:JQTWDEYKDRQPDU-UHFFFAOYSA-N
ID: 89114
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1=CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.484
InChIKey:SFQCHTBSAMCNBB-UHFFFAOYSA-N
ID: 89115
SMILES:C1(C)(C)C2C3=C(OC4(COC(O)(C4O)c4c(O)cc(CCCCC)cc4O)C3C(C)(C)O2)CC2C1OC(=O)C2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.652
CB1 binding score: -12.823
InChIKey:YVUIEVMKAVUEOE-UHFFFAOYSA-N
ID: 89116
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1cc(O)c(CC=C(CCC=C(C)C)C)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 464.646
CB1 binding score: -15.652
InChIKey:PYZLMGYEMYCJSG-UHFFFAOYSA-N
ID: 89117
SMILES:C1C(C)C2C(C1)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.57
InChIKey:JWVNDMUNWMFDDK-UHFFFAOYSA-N
ID: 89118
SMILES:c1c(O)cc(OC)c(O)c1C1C(CC=C(CCC=C(C)C)C)(C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.684
InChIKey:AEADRWVHKBSLRR-UHFFFAOYSA-N
ID: 89119
SMILES:CC1=CC2c3c(=O)cc(CCC)cc(OC)c3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.8
InChIKey:VLJNBQIUBSHSLG-UHFFFAOYSA-N
ID: 89120
SMILES:COc1cc(O)c(C(CC(C)C)=O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.527
InChIKey:NCPVKITZEUEXJY-UHFFFAOYSA-N
ID: 89121
SMILES:C(C)(=CCCC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 89122
SMILES:c1(O)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 89123
SMILES:C=C(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 89124
SMILES:O=C(Cc1c(O)cc(C)c(O)c1)C(C)=CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.572
InChIKey:ATKJTFDNVGXTJE-UHFFFAOYSA-N