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CHEBI:31552 - Epristeride

ChEBI IDCHEBI:31552
ChEBI NameEpristeride
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC25H37NO3
Net Charge0
Average Mass399.575
Monoisotopic Mass399.27734
SMILES[H][C@@]12CC=C3C=C(C(=O)O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](C(=O)NC(C)(C)C)CC[C@@]21[H]
InChIInChI=1S/C25H37NO3/c1-23(2,3)26-21(27)20-9-8-18-17-7-6-16-14-15(22(28)29)10-12-24(16,4)19(17)11-13-25(18,20)5/h6,14,17-20H,7-13H2,1-5H3,(H,26,27)(H,28,29)/t17-,18-,19-,20+,24-,25-/m0/s1
InChIKeyVAPSMQAHNAZRKC-PQWRYPMOSA-N
ChEBI Ontology
Outgoing Relation(s)
Epristeride (CHEBI:31552) is a steroid acid (CHEBI:47891)
Synonym  Source
EpristerideKEGG COMPOUND
Manual XrefsDatabases
D01134KEGG DRUG
Registry NumbersSources
CAS:119169-78-7KEGG COMPOUND