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CHEBI:232183 - gamma-aminobutyrolithocholic acid

Default Structure
ChEBI IDCHEBI:232183
ChEBI Namegamma-aminobutyrolithocholic acid
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC28H47NO4
Net Charge0
Average Mass461.687
Monoisotopic Mass461.35051
SMILESC[C@H](CCC(=O)NCCCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIInChI=1S/C28H47NO4/c1-18(6-11-25(31)29-16-4-5-26(32)33)22-9-10-23-21-8-7-19-17-20(30)12-14-27(19,2)24(21)13-15-28(22,23)3/h18-24,30H,4-17H2,1-3H3,(H,29,31)(H,32,33)/t18-,19-,20-,21+,22-,23+,24+,27+,28-/m1/s1
InChIKeyOQXPELKQNWQUKY-CUYCEIPOSA-N
ChEBI Ontology
Outgoing Relation(s)
gamma-aminobutyrolithocholic acid (CHEBI:232183) is a organic molecular entity (CHEBI:50860)