ID: 116488
SMILES:CCC(C(Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)C1=O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.255
InChIKey:VDXKJKLNTZLQBP-UHFFFAOYSA-N
ID: 116489
SMILES:c1c(OC)cc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.764
InChIKey:NRRZXOLZVDIGDT-UHFFFAOYSA-N
ID: 116490
SMILES:c1(O)cc(C2C=C(C)CCC2C(=C)C)c(O)c(C(=O)CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.847
InChIKey:ITEDRIMTXWWKMH-UHFFFAOYSA-N
ID: 116491
SMILES:C1(C(C)(O)C)CC(O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.88
InChIKey:WLCIBYYEYMEEIL-UHFFFAOYSA-N
ID: 116492
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: 116493
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 116494
SMILES:C1C(C(=C)C)C(c2ccc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 116495
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(CO)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19
InChIKey:AWUDMACGDPCMRJ-UHFFFAOYSA-N
ID: 116496
SMILES:C1=CC(C)(C)Oc2c1cc(CCCCC)cc2OC(C(O)(C)C(C)(O)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.929
InChIKey:UDXBJBKRDNYMAW-UHFFFAOYSA-N
ID: 116497
SMILES:C1(=CC=CC)c2c(cc(CCCCC)cc2O)OC(C)(C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.414
InChIKey:AVFKMLAWSXWGMV-UHFFFAOYSA-N
ID: 116498
SMILES:C(=O)(C)Oc1c(CCCCC)cc2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -16.7
InChIKey:KIQYTGJYQOBHGD-UHFFFAOYSA-N
ID: 116499
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.908
InChIKey:XKUSKYTWDSSQNW-UHFFFAOYSA-N
ID: 116500
SMILES:CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 116501
SMILES:O1c2cc(CCC)cc(O)c2CC2CCCC(C)C12O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -14.753
InChIKey:DQYOYXXJVNHFEC-UHFFFAOYSA-N
ID: 116502
SMILES:C(CCC)Cc1cc(O)c(C2C(C(=C)C)CCC(C(=O)OC)=CC2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: Not available
InChIKey:FFGMZAPUAWIBKS-UHFFFAOYSA-N
ID: 116503
SMILES:C1C=C(C)C(O)C(c2c(O)cc(CCC)cc2OC)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.98
InChIKey:LIVYCHGQEJATQY-UHFFFAOYSA-N
ID: 116504
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C)(OC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.887
InChIKey:USLURTWWQDGMPY-UHFFFAOYSA-N
ID: 116505
SMILES:CC(C)C1CC=C(C)C2Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.74
InChIKey:QDEICQYZWSNVPY-UHFFFAOYSA-N
ID: 116506
SMILES:C(C)(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 116507
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(CCC3C(=C)CCC4C3(C)CCCC4(C)C)C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.407
InChIKey:FSVCDOHOEIJDFC-UHFFFAOYSA-N
ID: 116508
SMILES:c1(O)cc(CCCCC)cc2c1-c1cc3c(cc1)CCC(C(C)=C)C2C=C3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.552
CB1 binding score: -14.306
InChIKey:CYXZYQGSAGLGMT-UHFFFAOYSA-N