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InChIKey | QGWDYPREORDRIT-LPXJIFNVSA-M |
InChI | InChI=1S/C30H44O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21,23H,8-15,17H2,1-7H3,(H,33,34)/p-1/t19-,21-,23+,26+,27-,28-,29+,30+/m0/s1 |
SMILES | CC1(C)[C@@H]2CC[C@]3(C)[C@H](C(=O)C=C4[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@@]34C)C([O-])=O)[C@@]2(C)CCC1=O |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 2 |
Distinct compatimentalized reactions in models | 0 |
Identifier | Description |
---|---|
keggC:C02943 | 3-Oxoglycyrrhetinate |
chebi:16404 | 3-oxoglycyrrhetinic acid 3,11-dioxoolean-12-en-30-oic acid 3-Oxoglycyrrhetinate |
chebi:57760 | 3-oxoglycyrrhetinate 3,11-dioxoolean-12-en-30-oate |
lipidmaps:LMPR0106150012 | 3-oxoglycyrrhetinic acid 3,11-dioxoolean-12-en-30-oic acid 3-Oxoglycyrrhetinate 3-oxoglycyrrhetinic acid |
metacycM:3-OXOGLYCYRRHETINATE | 3-oxoglycyrrhetinate |
chebi:11874 chebi:1638 chebi:20170 keggC:M_C02943 seedM:M_cpd01886 | secondary/obsolete/fantasy identifier |
seedM:cpd01886 | 3-Oxoglycyrrhetinate 3-oxoglycyrrhetinate |