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CHEBI:79528 - 4-Aminoestra-1,3,5(10)-triene-3,17beta-diol

ChEBI IDCHEBI:79528
ChEBI Name4-Aminoestra-1,3,5(10)-triene-3,17beta-diol
Stars
Last Modified20 January 2015
DownloadsMolfile
FormulaC18H25NO2
Net Charge0
Average Mass287.403
Monoisotopic Mass287.18853
SMILES[H][C@@]12CCc3c(ccc(O)c3N)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C18H25NO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h4,6,11-12,14,16,20-21H,2-3,5,7-9,19H2,1H3/t11-,12-,14+,16+,18+/m1/s1
InChIKeyDIDANTCTDBQPRP-ZHIYBZGJSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Aminoestra-1,3,5(10)-triene-3,17beta-diol (CHEBI:79528) is a 3-hydroxy steroid (CHEBI:36834)
Manual XrefsDatabases
C15005KEGG COMPOUND