ID: 43912
SMILES:CC(C)Cc1c(O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: Not available
InChIKey:LSIMXNPVMNVXEX-UHFFFAOYSA-N
ID: 43913
SMILES:COc1cc2c3c(cc(C)c2)OC(C)(C)C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 216.28
CB1 binding score: -15.615
InChIKey:ABFVRUZPSZEEQM-UHFFFAOYSA-N
ID: 43914
SMILES:BrC1C(C)(C)Oc2c(c(O)cc(CCC)c2)C2=C1C(=O)C(O)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.32
CB1 binding score: -15.979
InChIKey:JLRKTMGAHZBFDE-UHFFFAOYSA-N
ID: 43915
SMILES:CCC1(C)C2C(C)(CCC1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.669
InChIKey:XRGJGTIFVGPTJR-UHFFFAOYSA-N
ID: 43916
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 43917
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 43918
SMILES:o1c(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 43919
SMILES:C(CC)CCCc1c(C)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.77
InChIKey:FPVAPQZFGKUXGQ-UHFFFAOYSA-N
ID: 43920
SMILES:Oc1cc(CCCCC)c(O)c2c1C1=C(C(=C)C)CCC(C)(O)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.943
InChIKey:APHHMIMSTZUIMJ-UHFFFAOYSA-N
ID: 43921
SMILES:CC12CCC(C)C(C)C1C1=C(OC2(C)C)C(=O)C2=C(C1=O)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.963
InChIKey:RRRCGQWORRJNKS-UHFFFAOYSA-N
ID: 43922
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 43923
SMILES:C1(OC2OC(CO)C(O)C(O)C2O)C2(C)C3C(c4c(cc(CCCCC)cc4O)OC3)C=C2CC(CO)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.673
CB1 binding score: Not available
InChIKey:XDRJNRPVVTYILA-UHFFFAOYSA-N
ID: 43924
SMILES:C1C(C(=O)OC)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.376
InChIKey:UTAIYJNUTPGSHW-UHFFFAOYSA-N
ID: 43925
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C=C(C)C(OC(=O)CCC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.572
InChIKey:LTDBCWWSIVEEKK-UHFFFAOYSA-N
ID: 43926
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.388
InChIKey:SPQILLGTJLAJPN-UHFFFAOYSA-N
ID: 43927
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 43928
SMILES:CC1(CCC=C(C)C)Oc2cc(CCCC)c(O)c(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.334
InChIKey:LIFIGNLFWIMGAU-UHFFFAOYSA-N
ID: 43929
SMILES:C(C1C2(c3c(O)cc(CCCCC)cc3OC2=O)C2OC1(C)CCC(C(C)(C)O)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.513
CB1 binding score: -15.052
InChIKey:ITLPLUDSZFDHGP-UHFFFAOYSA-N
ID: 43930
SMILES:Oc1c(CCCCC)cc(O)c2c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.076
InChIKey:DGYADGILUPASIB-UHFFFAOYSA-N
ID: 43931
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 43932
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N