ID: 63379
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 63380
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.153
InChIKey:FHFWMWLGGRCLAF-UHFFFAOYSA-N
ID: 63381
SMILES:C(COc1cc(O)c(C(O)=O)c2c1OC(C)(C)C1C2C=C(C)CC1)CC=C(C)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.753
CB1 binding score: Not available
InChIKey:LHXUZJATXWWYSU-UHFFFAOYSA-N
ID: 63382
SMILES:O(C(NC)=O)c1cc2c(cc1C)OC(C)(C)C1C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.429
CB1 binding score: -17.137
InChIKey:RGNNQRVIUPEMEZ-UHFFFAOYSA-N
ID: 63383
SMILES:CC(C)=CCc1c(CCCCC)cc2c(c1O)C1C=C(C(=O)O)CCC1(O)C(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -17.298
InChIKey:QKDNFFCZFHMYDJ-UHFFFAOYSA-N
ID: 63384
SMILES:C(C1CC(C(C)C)C(c2c(O)cc(CCCCC)c(O)c2)C=C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.095
InChIKey:FRJHXGRFXVGNAV-UHFFFAOYSA-N
ID: 63385
SMILES:CC1(C)OCC(C(=O)O)C2(O)C(=O)c3c(cc(CCCCC)cc3O)OC21C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.448
CB1 binding score: -16.177
InChIKey:PEDQEWJRFAUISC-UHFFFAOYSA-N
ID: 63386
SMILES:O(C(=O)C)C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.887
InChIKey:QNVQIUIKZFUENN-UHFFFAOYSA-N
ID: 63387
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 63388
SMILES:c1(CCCCC)cc2c3c(c1O)OC(C)(C)C1CCC(C)(C21)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.156
InChIKey:TZTCBVLGWFKIRD-UHFFFAOYSA-N
ID: 63389
SMILES:C1CC2(C)C(OC(C)=O)C=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.138
InChIKey:IERSMSPKUNREFU-UHFFFAOYSA-N
ID: 63390
SMILES:C1=C(C)CCC=C(C)COc2c3c(cc(C)c21)OC(C)(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -9.415
InChIKey:UJZWIDPLIQNNEV-UHFFFAOYSA-N
ID: 63391
SMILES:O(C(C)=O)C1C2C(CC(=C)C1)c1c(O)cc(CCCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.707
InChIKey:FCWGJZPMBKZAGE-UHFFFAOYSA-N
ID: 63392
SMILES:c1(O)c(C(C(C)C)=O)c2c(c(OC)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.218
InChIKey:MCVVQEJULGVJSH-UHFFFAOYSA-N
ID: 63393
SMILES:CC1=CC2C(C(C)(C)Oc3c(C)cc(O)cc32)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.421
InChIKey:VMOMSVGCGZZPNL-UHFFFAOYSA-N
ID: 63394
SMILES:c1occ(C=CC2(C)Oc3c(c(O)cc(CCCCC)c3)C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.156
InChIKey:FQKDRWALUSAPJD-UHFFFAOYSA-N
ID: 63395
SMILES:C(CCCc1cc2c(c(O)c1OC)C13C(C(C)(CCCC(C)C)OC1)C(C=C3)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.247
InChIKey:HSTIBDRTFGVJJG-UHFFFAOYSA-N
ID: 63396
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 63397
SMILES:OC12C(C)CCC3CC1c1c(O)cc(CCCCC)cc1OC3(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -12.123
InChIKey:AXCJTBXRMXNDGS-UHFFFAOYSA-N
ID: 63398
SMILES:c1(O)c(OC)c(CCCCC)c2c(c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.333
InChIKey:JROYKLRHWNONTJ-UHFFFAOYSA-N
ID: 63399
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C=C(C=O)C)C1C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.749
InChIKey:NTYRGCQMKIOWCN-UHFFFAOYSA-N