ID: 40111
SMILES:CC12C3(CC(CC1)C(C)(C)O3)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.047
InChIKey:DYULFNGBDJQUJT-UHFFFAOYSA-N
ID: 40112
SMILES:c1(O)cc(C(CCCC)OC2(C)CCC(C(=C)C)CC2)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.171
InChIKey:PAOCNUAQLFXWDR-UHFFFAOYSA-N
ID: 40113
SMILES:C(COC)c1cc2c(c(O)c1)C1=C(C3C(C=C1C(OC)=O)C(C)CO3)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -16.159
InChIKey:NRMXUGFEDLVECR-UHFFFAOYSA-N
ID: 40114
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 40115
SMILES:c1(C=O)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.644
InChIKey:WQWGRCLYCMEVLH-UHFFFAOYSA-N
ID: 40116
SMILES:CC1(C)Oc2c(c(O)cc(CC)c2)C2CC1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -12.047
InChIKey:LDKLHHNKGYLBSD-UHFFFAOYSA-N
ID: 40117
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CO)C2(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -15.106
InChIKey:XTWGNDMIHNWJGA-UHFFFAOYSA-N
ID: 40118
SMILES:CC(C)=CCCC1(C)C2c3c4c(c(C)cc3O)C(C(C)C)(O4)CCC2=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.568
InChIKey:LRXTUCKYICEUBG-UHFFFAOYSA-N
ID: 40119
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C3C=C(C)CCC3C1(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.116
InChIKey:RTJDZMYNRYVMFF-UHFFFAOYSA-N
ID: 40120
SMILES:C(Cc1cc(O)ccc1O)c1c(CCCC)cc2c(c1O)C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.575
CB1 binding score: -11.776
InChIKey:ARBBYZPHJKONIN-UHFFFAOYSA-N
ID: 40121
SMILES:c1c2c(c(O)c(C(=O)C=C(CCC=C(C)C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -17.938
InChIKey:GRNHWVBUEVSZIA-UHFFFAOYSA-N
ID: 40122
SMILES:C(C=C(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 40123
SMILES:COc1c(C(C(C)C)C(C)=O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.266
InChIKey:DFBUXUQPRDIFQM-UHFFFAOYSA-N
ID: 40124
SMILES:c1(CCCC(CCCC2(C)Oc3cc(CCCCC)cc(O)c3C2)C)ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -12.876
InChIKey:LFNLUNRHUAOLDP-UHFFFAOYSA-N
ID: 40125
SMILES:CC(C(C(O)CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.116
InChIKey:FNKKMKWMDDKFCW-UHFFFAOYSA-N
ID: 40126
SMILES:C(C(c1cc2c(c(O)c1)C1C(O2)C(C)(C)OCC1=O)C)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.363
InChIKey:HBPHGIHOODSFNU-UHFFFAOYSA-N
ID: 40127
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cc(C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 270.416
CB1 binding score: -17.979
InChIKey:ZLPGXSHLPLOFQK-UHFFFAOYSA-N
ID: 40128
SMILES:C1(O)CC2(C)C(C)(CCC2)C2(c3c(cc(CCCCC)cc3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.787
InChIKey:SLXGZOLTZTZHGY-UHFFFAOYSA-N
ID: 40129
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C2=C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.06
InChIKey:WQVFVTKXRBQFFH-UHFFFAOYSA-N
ID: 40130
SMILES:C(CCCC(C1CC(c2c(O)cc(CCCCC)cc2)=C(C)C(=O)C1)C(C(O)=O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.324
InChIKey:BQQWQIGVPZPPGV-UHFFFAOYSA-N
ID: 40131
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -16.967
InChIKey:VXPQHRAEZUDOFC-UHFFFAOYSA-N