ID: 78142
SMILES:COc1c2c(c3c(c1)C(=O)CC(O)(C)C3)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.094
InChIKey:IUOCMULRDKLYAA-UHFFFAOYSA-N
ID: 78143
SMILES:Oc1cc(CCCCC)cc2c1C1C(=O)C3(C(C)(CC1=O)C1(C)CCC(CCC4OC4(C)C)(C)OC1C3=O)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.691
CB1 binding score: -15.459
InChIKey:NCMFGYPVIQDSMG-UHFFFAOYSA-N
ID: 78144
SMILES:OC(CCC(c1c(C(C(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.041
InChIKey:IFSVTJNMBPPXOK-UHFFFAOYSA-N
ID: 78145
SMILES:c1c(CCc2cc(O)cc(O)c2)c(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 396.483
CB1 binding score: -12.354
InChIKey:OJRRTUYCCMOTNQ-UHFFFAOYSA-N
ID: 78146
SMILES:C(C)(C1C=CC(C)=CC1c1c(O)cc(CCCCCO)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.77
InChIKey:SQIVXSDBUSSEMR-UHFFFAOYSA-N
ID: 78147
SMILES:C12=CCCC3(C)C1C(c1c(cc(CCCCC)cc1O)O3)CC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -11.635
InChIKey:KOZXOIPEABHFQZ-UHFFFAOYSA-N
ID: 78148
SMILES:c12c(c3c(cc(O)cc3O)cc1O)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -15.245
InChIKey:BBGDWOORENNMON-UHFFFAOYSA-N
ID: 78149
SMILES:O=C1c2c(CCCCC)cc(O)cc2OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -15.929
InChIKey:URAMDVWSZYVAFT-UHFFFAOYSA-N
ID: 78150
SMILES:C1(C)(C)C2=C(CC(C)CC2=O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -20.286
InChIKey:AGZINCZHMGNOIG-UHFFFAOYSA-N
ID: 78151
SMILES:C1CC(CCCC2(C)Oc3c(C)cc(O)cc3C=C2)=C(C)CC1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -12.21
InChIKey:YYJJBIOZECCUQZ-UHFFFAOYSA-N
ID: 78152
SMILES:C1(C)=CCC(C)(C)C2Cc3c(c(C(=O)O)cc(CCCCC)c3)OC2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.552
InChIKey:RAWCRNDOWVPPGS-UHFFFAOYSA-N
ID: 78153
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 78154
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)c(C2OC(C(O)=O)C(O)C(O)C2O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -15.789
InChIKey:KHSXXLHNICSDJZ-UHFFFAOYSA-N
ID: 78155
SMILES:C12CC(C)(Oc3cc(CCCCCCl)cc(O)c31)C(OC(=O)C)CC(C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.977
CB1 binding score: -14.83
InChIKey:GLXPIMKZYMBFOS-UHFFFAOYSA-N
ID: 78156
SMILES:C(Oc1cc2c(cc1OC(C)=O)OC(C)(C)C1C2CC(C)=CC1)(C)=NCCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.575
CB1 binding score: -14.948
InChIKey:PJAXGMQROYWSSL-UHFFFAOYSA-N
ID: 78157
SMILES:CC1=CCCC(O)(C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.093
InChIKey:CBTPIOMAJKYHLC-UHFFFAOYSA-N
ID: 78158
SMILES:C(C=C(C)C)CC1(C)Oc2c(c(O)cc(CCCCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.376
InChIKey:AAZSXXIEAYXFSH-UHFFFAOYSA-N
ID: 78159
SMILES:C(C(c1cc(O)c2c(c1)OC(CCC1OC1(C)C)(C)CC2)(C)C)(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.134
InChIKey:YFFKQWMXWJLADT-UHFFFAOYSA-N
ID: 78160
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 78161
SMILES:c1(O)c(C(OC)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -18.067
InChIKey:OZGZWGBHXPFAHB-UHFFFAOYSA-N
ID: 78162
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N