ID: 102061
SMILES:CC1(C)Oc2cc(CCCCCOC(C=CC(O)=O)=O)cc(O)c2C2C1(O)C=CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.508
CB1 binding score: -14.971
InChIKey:IOUWHKIAQBBUGN-UHFFFAOYSA-N
ID: 102062
SMILES:C(=CCC(C)C1CCC2(C)Oc3c(c(O)cc(CCC)c3)C=C2C1C)C=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.084
InChIKey:VCRYZKAXDWNYIH-UHFFFAOYSA-N
ID: 102063
SMILES:CC(C1CCC(C)=C2C1C=C(CCC=C(C#CC)C)C(=O)O2)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -14.431
InChIKey:SJCNZWBROGNIAF-UHFFFAOYSA-N
ID: 102064
SMILES:C1(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 102065
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCCCC)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.593
InChIKey:RHRYIQNXICLAPT-UHFFFAOYSA-N
ID: 102066
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.943
InChIKey:KYRROFIRFUYHRQ-UHFFFAOYSA-N
ID: 102067
SMILES:C1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -19.22
InChIKey:AHKIGVNVQSVNEP-UHFFFAOYSA-N
ID: 102068
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 102069
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 102070
SMILES:CC(O)(C=CCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.81
InChIKey:SZYKXWKCBRZDMT-UHFFFAOYSA-N
ID: 102071
SMILES:CC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -20.991
InChIKey:VUUOQMIMZAXLBK-UHFFFAOYSA-N
ID: 102072
SMILES:Oc1c(CC=C(CCC=C(CCC=C(C)C)C)C)c(O)cc(CCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.393
InChIKey:PHVGPKALUWIASL-UHFFFAOYSA-N
ID: 102073
SMILES:Oc1cc(CCCCC)cc(O)c1C1C(C(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 102074
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 102075
SMILES:CC(C1CCC(C)CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 102076
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C2C=CC(C)=CC(=O)OC)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.395
InChIKey:CXTGPFHAVRPQAZ-UHFFFAOYSA-N
ID: 102077
SMILES:C1C(C)=CC(c2c(O)cc(C(=O)OCC(O)C)cc2)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.174
InChIKey:SGOBRERJUSFSEW-UHFFFAOYSA-N
ID: 102078
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(Br)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -17.342
InChIKey:NXKAKZZDJLSBSI-UHFFFAOYSA-N
ID: 102079
SMILES:C1C(C(C)=C)Cc2c(ccc(CCCC(C)C)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.405
CB1 binding score: -15.241
InChIKey:KHQRHFZWTACDRG-UHFFFAOYSA-N
ID: 102080
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC3(C)CCCC(C)(C)C3)OC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.828
InChIKey:HCKQNVNLDVLHDH-UHFFFAOYSA-N
ID: 102081
SMILES:C(c1c2c(c(C(OC)=O)c(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -18.44
InChIKey:BHIQQCVUOQPTCJ-UHFFFAOYSA-N