ID: 55252
SMILES:C(=C(C)C(O)CC=C(CCC=C(C)C)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.383
InChIKey:QAXAOPIIOMXCJZ-UHFFFAOYSA-N
ID: 55253
SMILES:C1(c2c(O)cc(O)c(CC=C(CCC=C(C)C)C)c2)OC(C)(C)C2C1C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.627
InChIKey:YBHOCKQURQGACT-UHFFFAOYSA-N
ID: 55254
SMILES:C1(C)(C)C2CC=C(CO)C2Cc2ccccc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.329
InChIKey:NFSUOGWCUYVSRF-UHFFFAOYSA-N
ID: 55255
SMILES:O=C(C)OC1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.314
InChIKey:KIPOYGDBLDUBRH-UHFFFAOYSA-N
ID: 55256
SMILES:C1(C(C)C)C(OC(=O)c2c(O)cc(OC)cc2C)CC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.644
CB1 binding score: -15.87
InChIKey:WQSSUPVYNRGWJP-UHFFFAOYSA-N
ID: 55257
SMILES:C1(C(C)(O)C)CCC2(C)C(O)C3c4c(O)cc(CCCCC)cc4OC(O)(C32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -13.58
InChIKey:HZXVHKFHJOIANN-UHFFFAOYSA-N
ID: 55258
SMILES:C1(=O)C(O)C2C(CC1(C)C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.291
InChIKey:UDWLYBIAZYOLCM-UHFFFAOYSA-N
ID: 55259
SMILES:CC(C)C1C2(Oc3c(O)cc(C[N+](O)=O)c(CC=C(CO)C)c3)C(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.564
CB1 binding score: -16.442
InChIKey:IKUQZCVTYAWBMH-UHFFFAOYSA-O
ID: 55260
SMILES:C1CC(C)(C)C2C(O)C3(O)OCC2(C1)C3C(C(O)=O)Oc1ccc(CCCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.583
CB1 binding score: -17.818
InChIKey:RKGLACOWSZJLSF-UHFFFAOYSA-N
ID: 55261
SMILES:C1(C)(C)CCCC(C)(c2c(O)cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -16.965
InChIKey:YDILICWVLNQIRY-UHFFFAOYSA-N
ID: 55262
SMILES:C(CCC)CCc1cc2c(c(O)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 55263
SMILES:C(CC)(C)CC(=O)OCc1cc(O)c(CC=C(CC(C=C(C)C)O)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.382
InChIKey:VSSNGSGZGHYVMX-UHFFFAOYSA-N
ID: 55264
SMILES:C1(O)C(C)(C)Oc2c(C(O)=O)c(CCCCC)cc(O)c2C=CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -16.143
InChIKey:VWMKGVIFQMSEDY-UHFFFAOYSA-N
ID: 55265
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55266
SMILES:O=C(OCCC1(C)C(C(C)=C)CC=C(C)C12Cc1c(cc(CCCCC)cc1O)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.845
InChIKey:YEHQLRWZTMFMKJ-UHFFFAOYSA-N
ID: 55267
SMILES:C1(C)=CC2c3c(OC)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 55268
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C3C(CC(C)(C1C)C3=O)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.428
InChIKey:WBLSFBZUTKYYRC-UHFFFAOYSA-N
ID: 55269
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 55270
SMILES:C1(C(C)C)CCC(=C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.51
InChIKey:ABUYMDYRFWRXCE-UHFFFAOYSA-N
ID: 55271
SMILES:c1c2c(cc(O)c1)C1=CC(CC=C(CCC=C(C)C)C)(C)OC(C)(C)C1CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.637
CB1 binding score: -14.205
InChIKey:XFBKYOFQOSBVQL-UHFFFAOYSA-N
ID: 55272
SMILES:C1C(C(=C)C)C(c2c(O)cc(CC)cc2O)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.413
InChIKey:CBPWDDBVKIFXRH-UHFFFAOYSA-N