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CHEBI:79566 - Pregna-5,16,20-triene-3beta,20-diol diacetate

ChEBI IDCHEBI:79566
ChEBI NamePregna-5,16,20-triene-3beta,20-diol diacetate
Stars
DownloadsMolfile
FormulaC25H34O4
Net Charge0
Average Mass398.543
Monoisotopic Mass398.24571
SMILES[H][C@@]12CC=C3C[C@@H](OC(C)=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C(C(=C)OC(C)=O)=CC[C@@]21[H]
InChIInChI=1S/C25H34O4/c1-15(28-16(2)26)21-8-9-22-20-7-6-18-14-19(29-17(3)27)10-12-24(18,4)23(20)11-13-25(21,22)5/h6,8,19-20,22-23H,1,7,9-14H2,2-5H3/t19-,20-,22-,23-,24-,25+/m0/s1
InChIKeyWVWYUFYNHHQVFI-ABVATSDPSA-N
ChEBI Ontology
Outgoing Relation(s)
Pregna-5,16,20-triene-3beta,20-diol diacetate (CHEBI:79566) is a steroid ester (CHEBI:47880)
Manual XrefsDatabases
C15046KEGG COMPOUND