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CHEBI:232239 - 7-oxo-gamma-aminoisobutyrolithocholic acid

Default Structure
ChEBI IDCHEBI:232239
ChEBI Name7-oxo-gamma-aminoisobutyrolithocholic acid
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC28H45NO5
Net Charge0
Average Mass475.670
Monoisotopic Mass475.32977
SMILESC[C@H](CCC(=O)NCCCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(=O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIInChI=1S/C28H45NO5/c1-17(6-9-24(32)29-14-4-5-25(33)34)20-7-8-21-26-22(11-13-28(20,21)3)27(2)12-10-19(30)15-18(27)16-23(26)31/h17-22,26,30H,4-16H2,1-3H3,(H,29,32)(H,33,34)/t17-,18+,19-,20-,21+,22+,26+,27+,28-/m1/s1
InChIKeyOZWXXLMYIMLSOS-HATUNHQXSA-N
ChEBI Ontology
Outgoing Relation(s)
7-oxo-gamma-aminoisobutyrolithocholic acid (CHEBI:232239) is a organic molecular entity (CHEBI:50860)