ID: 58087
SMILES:c1(CCCC)cc2c3c(c1)OC(C)(C)C1C3C(CCC(C)=C1)OC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.195
InChIKey:YSAUQXYXQYZLRD-UHFFFAOYSA-N
ID: 58088
SMILES:C1OC12c1c(cc(CCCCCCCC)cc1OC(=O)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.616
InChIKey:MYURUXPLUOQZCM-UHFFFAOYSA-N
ID: 58089
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 58090
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC3(CC(O)C(C)(C)O3)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.651
InChIKey:IFJWPSFMXJTHDY-UHFFFAOYSA-N
ID: 58091
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.943
InChIKey:ZLPWOARYLIQCFD-UHFFFAOYSA-N
ID: 58092
SMILES:C1C2C(C)(Oc3cc(CCC)cc(O)c32)C2CC(CC#N)C(C(=O)O)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 355.434
CB1 binding score: -19.179
InChIKey:ADANKOBELBJRRD-UHFFFAOYSA-N
ID: 58093
SMILES:O=C(CC(C)C)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C(C(C)=CC2=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.043
InChIKey:LNRGRBWLUPKEJF-UHFFFAOYSA-N
ID: 58094
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 58095
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 58096
SMILES:c12cc(CCCCC)cc(O)c1C1C(CC=C(CCC=C(CCC=C(C)C)C)C)(O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.835
InChIKey:BXFAGQFYYUAVGZ-UHFFFAOYSA-N
ID: 58097
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c-2ccc(O)c1CC(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.02
InChIKey:QOTAERDICZKWJH-UHFFFAOYSA-N
ID: 58098
SMILES:C(C)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 58099
SMILES:C=CCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.145
InChIKey:TWWHGGVEXMQXNY-UHFFFAOYSA-N
ID: 58100
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 58101
SMILES:c12c(c(OC)c(OC)c(CCC(C)C)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.455
InChIKey:WYGIOSCDWJVBGG-UHFFFAOYSA-N
ID: 58102
SMILES:C(C)(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.562
InChIKey:WHTOMQKXBRDPDZ-UHFFFAOYSA-N
ID: 58103
SMILES:OCC1=CCCC(C)=CCC2C(C)(C)Oc3cc(CCc4cccc(O)c4)cc(C)c3C2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.642
CB1 binding score: -17.434
InChIKey:JGWDRZSORRMFMZ-UHFFFAOYSA-N
ID: 58104
SMILES:c1(CCCCC)ccc(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.467
InChIKey:TVERKJMGSVKUPT-UHFFFAOYSA-N
ID: 58105
SMILES:C(C)(C(c1c(C)c(O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.029
InChIKey:UUNSOSMVOLPFTA-UHFFFAOYSA-N
ID: 58106
SMILES:c12c(cc(C(O)=C)c(C3C(C(C)=C)CCC(C)=C3)c1O)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -13.99
InChIKey:BTHRXJPBZLMOBE-UHFFFAOYSA-N
ID: 58107
SMILES:C(CC)Cc1cc(O)c(C2C(C(C)(C)O)CCC(O)(C)CC=C2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.621
InChIKey:ONXDAIRTINKYKG-UHFFFAOYSA-N