ID: 109705
SMILES:c12c(C(=O)OC)cc(CCCCC)cc1OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.574
InChIKey:VSXUUHIPYQFCED-UHFFFAOYSA-N
ID: 109706
SMILES:c1c(OC(C)=O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.502
InChIKey:TZMATMIAOZYIKO-UHFFFAOYSA-N
ID: 109707
SMILES:C(CC1(O)C2(C=CC1C(CCc1cc(OC)c(O)cc1)C)C=CC(C)(C)OC2=O)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -16.166
InChIKey:IIKCIRYUYVUALY-UHFFFAOYSA-N
ID: 109708
SMILES:C(C1(C)C2C(c3c(cc(CCCCC)cc3O)O1)OC(CO)C2CCCC(CO)(C)O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.681
CB1 binding score: -13.131
InChIKey:NSVBGNIKHGCKQO-UHFFFAOYSA-N
ID: 109709
SMILES:Oc1c(C(C(=O)OC)=CC)nc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.423
CB1 binding score: -13.175
InChIKey:RTYVJGJCTHRBBG-UHFFFAOYSA-N
ID: 109710
SMILES:c1(OC)cc(CCC)cc2c1-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.584
InChIKey:UDXUQTAVFURHRS-UHFFFAOYSA-N
ID: 109711
SMILES:C(CCC)Cc1cc(O)c(C2CC(C)=CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 109712
SMILES:C(C(C)=C)c1c(O)c(O)cc(OC)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: Not available
InChIKey:LTWKNKTVDXTCQW-UHFFFAOYSA-N
ID: 109713
SMILES:C1(=C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 109714
SMILES:C12C(C)(c3c(O)cc(CCCCC)cc3OC1(C)C)C(O)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -12.753
InChIKey:XVPUWKHXTXOOMG-UHFFFAOYSA-N
ID: 109715
SMILES:c1(CC=C(C)CCC=C(C)CC(CCc2ccccc2)=O)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.734
CB1 binding score: -16.502
InChIKey:ASWZTLNWNJOCMM-UHFFFAOYSA-N
ID: 109716
SMILES:C(C)c1cc(O)c(C2OC(=O)CC(OC(C)=O)C2C(=O)CC(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.421
CB1 binding score: -13.453
InChIKey:JTAYVGIVAJAQPZ-UHFFFAOYSA-N
ID: 109717
SMILES:C1(O)C(=O)C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.82
InChIKey:RWWUDFZTNYXBAP-UHFFFAOYSA-N
ID: 109718
SMILES:O=C(c1cc2c(c(O)c1OC)C1C=C(C)CCC1C(C)(C)O2)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.826
InChIKey:AQEIHYWZJPFSLG-UHFFFAOYSA-N
ID: 109719
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 109720
SMILES:O1c2c(c(O)cc(C(C(CC)O)C)c2)C2C(O)C(C)C3(C)C12C(=O)C(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.231
InChIKey:SCBDRYMBEJDEKZ-UHFFFAOYSA-N
ID: 109721
SMILES:C(CCc1cc(O)c2c(c1)OCC1C(C(=C)C)C(CC(C)=C1)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.376
InChIKey:FYIQUJIOTRWLQP-UHFFFAOYSA-N
ID: 109722
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 109723
SMILES:c1(OCC)c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.359
InChIKey:MFWNLDXWJJGEJW-UHFFFAOYSA-N
ID: 109724
SMILES:O1c2cc(C)cc(O)c2C2CC(C)(CC(=O)C(=C(C)C)CC(O)C=C1C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.64
InChIKey:VGTMVISFNBLCKW-UHFFFAOYSA-N
ID: 109725
SMILES:C(C1C(CC(C)C)c2c(O)cc(CCCCC)cc2O1)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -13.144
InChIKey:AITLBDOYNWEABW-UHFFFAOYSA-N