ID: 105211
SMILES:C(c1ccc(O)c(O)c1)CCc1cc(O)c(CC=C(CCC=C(CCC(C(O)(C)C)O)C)C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.687
CB1 binding score: -12.297
InChIKey:JMHDZKYRTKXRIK-UHFFFAOYSA-N
ID: 105212
SMILES:c1(O)c(CC=C(C)C)cc(C=O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 340.463
CB1 binding score: -11.867
InChIKey:KBSXONGBTFXWHE-UHFFFAOYSA-N
ID: 105213
SMILES:c1cc(C)cc2c1C(C)(C)Oc1c-2c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -16.045
InChIKey:INWSLPFOEADNBM-UHFFFAOYSA-N
ID: 105214
SMILES:CC1C(=O)OC(C)(C)C1CCC1(C)Oc2c(C)cc(OC)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.596
InChIKey:IKRLZKVXSLVOOC-UHFFFAOYSA-N
ID: 105215
SMILES:C1=C(C(=O)O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 105216
SMILES:C1(O)C(O)C(CO)C2C(=O)c3c(O)cc(CCCCC)cc3OC2(C)CCC1C(C)(C)OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.599
CB1 binding score: -15.593
InChIKey:NLKWSFUYWRLNEK-UHFFFAOYSA-N
ID: 105217
SMILES:C1C(C)C2C(C)(C)Oc3cc(CCCCCC)cc(O)c3C2C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.096
InChIKey:VFWOAVLFHHKJCP-UHFFFAOYSA-N
ID: 105218
SMILES:CC(=CC(=O)CC(=CCc1c(O)cc(CCCCC)cc1O)C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.587
CB1 binding score: -18.498
InChIKey:IXCOZTMGSJNGJA-UHFFFAOYSA-N
ID: 105219
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)oc3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.511
InChIKey:GXWDSBIXUHGSDX-UHFFFAOYSA-N
ID: 105220
SMILES:c1(C2CC(=O)CC(C)=C2)cc(CC=C(C)C)c(O)c(CCC(C(O)CC=C(C)C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -13.394
InChIKey:CZDWCYPZTYZRLE-UHFFFAOYSA-N
ID: 105221
SMILES:C(C)(=CCCC(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: 105222
SMILES:C(CC)COc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.224
InChIKey:BKXPHWPXHPRUAB-UHFFFAOYSA-N
ID: 105223
SMILES:C1(C(C)=O)C2C(c3c(O)cc(CCCCC)cc3OC(C)(C)C2=O)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.75
InChIKey:DKDYTMUGQJOTGB-UHFFFAOYSA-N
ID: 105224
SMILES:C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 105225
SMILES:O1c2c(cc(CCCCC)cc2O)CC1C1(C)CC=C(C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.853
InChIKey:URAMANMMSOMPRN-UHFFFAOYSA-N
ID: 105226
SMILES:Oc1c(C(OC)=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 105227
SMILES:CC1(C)Oc2c(cc(OC)c(C)c2)C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -19.208
InChIKey:DBJJYKXSZRYDDY-UHFFFAOYSA-N
ID: 105228
SMILES:c1(CCCCC)cc2c(c(OC)c1)C1CC(C)=CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.103
InChIKey:NVOIIEFBVSAMJE-UHFFFAOYSA-N
ID: 105229
SMILES:c1(C(C)C)c(O)c(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.638
InChIKey:KNZHIMYZHKNYSW-UHFFFAOYSA-N
ID: 105230
SMILES:O1c2c(c(O)cc(CCC)c2)C2C1C(C)(C)C(C=CC(C)(C)O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.198
InChIKey:VXPVOSXZWGBSBU-UHFFFAOYSA-N
ID: 105231
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.821
InChIKey:CUWJKLPAOPPJHN-UHFFFAOYSA-N