ID: 65416
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 65417
SMILES:C(Oc1c2c(c(C(=O)O)c(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2)(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.929
InChIKey:FLHZHZHGTWPHRF-UHFFFAOYSA-N
ID: 65418
SMILES:c1(O)c2c(c(CCCCC)cc1O)OC(C)(C)C1=C2C(=O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.441
InChIKey:LIPKPXBQTBFUNA-UHFFFAOYSA-N
ID: 65419
SMILES:CC1=CC2C(C(C)(C)Oc3cc(C)c(Br)cc23)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 65420
SMILES:C1(C)(C=C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C(C(CCC=C(C)C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.308
InChIKey:JDUBPGWBPPURPV-UHFFFAOYSA-N
ID: 65421
SMILES:C1C(O)C(C)=CC2c3c(cc(CCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.594
InChIKey:HLKPWAVXQLIKRO-UHFFFAOYSA-N
ID: 65422
SMILES:C1(=O)C(C)(O)C2(C)CCC(C=O)=CC2c2c(O)cc(CCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.192
InChIKey:BCSWUHVQKCMZOQ-UHFFFAOYSA-N
ID: 65423
SMILES:c1(C(=O)CC(C)C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.055
InChIKey:OAEMYZLSFWZUEY-UHFFFAOYSA-N
ID: 65424
SMILES:c1(=O)c(C)c(C2C=C(C)CCC2C(C)=C)c(O)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.325
InChIKey:WMXGDVPMNMDZQS-UHFFFAOYSA-N
ID: 65425
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 65426
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 65427
SMILES:C1(C(C)(C)O)Oc2c(c(O)c(C3=C(CC=O)C4C=C(CO)CCC4C(C)(C)O3)c(CCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -14.471
InChIKey:IWOHOLAMKYDSAX-UHFFFAOYSA-N
ID: 65428
SMILES:Oc1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.49
InChIKey:ONIJWLZTUANPKG-UHFFFAOYSA-N
ID: 65429
SMILES:Oc1c(=O)c(O)c2c(cc1OC)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.368
CB1 binding score: -16.338
InChIKey:GYDIMVDVRCACQW-UHFFFAOYSA-N
ID: 65430
SMILES:C12(C)Oc3c(cc(C(CC(OC)=O)OC(C)=O)c(CCCCC)c3)C1C=C(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.837
InChIKey:RFXIODNXWLKBCP-UHFFFAOYSA-N
ID: 65431
SMILES:C1(C)=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 65432
SMILES:C1c2cc(CCCC)ccc2OC(C)(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.249
InChIKey:UYCAKSVXQCBHGA-UHFFFAOYSA-N
ID: 65433
SMILES:c12cc(CCCC(O)C)c3c(c1O)OC(C)(C)C1CCC(C)(C21)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.484
InChIKey:CQDHSOLFECJZFG-UHFFFAOYSA-N
ID: 65434
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 65435
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 65436
SMILES:C(CCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)OC(C)=O)c1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 402.531
CB1 binding score: -17.664
InChIKey:AYIRJXPFGGVROY-UHFFFAOYSA-N