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CHEBI:79817 - 1-Methylestra-1,3,5(10)-triene-3,17beta-diol

ChEBI IDCHEBI:79817
ChEBI Name1-Methylestra-1,3,5(10)-triene-3,17beta-diol
Stars
Last Modified20 January 2015
DownloadsMolfile
FormulaC19H26O2
Net Charge0
Average Mass286.415
Monoisotopic Mass286.19328
SMILES[H][C@@]12CCc3cc(O)cc(C)c3[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C19H26O2/c1-11-9-13(20)10-12-3-4-14-15(18(11)12)7-8-19(2)16(14)5-6-17(19)21/h9-10,14-17,20-21H,3-8H2,1-2H3/t14-,15+,16+,17+,19+/m1/s1
InChIKeyYFECXKBRYLRUTI-QSUVVDIXSA-N
ChEBI Ontology
Outgoing Relation(s)
1-Methylestra-1,3,5(10)-triene-3,17beta-diol (CHEBI:79817) is a 3-hydroxy steroid (CHEBI:36834)
Synonym  Source
1-MethylestradiolKEGG COMPOUND
Manual XrefsDatabases
C15315KEGG COMPOUND