CHEBI:79735 - beta-Estradiol 17-acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name beta-Estradiol 17-acetate
ChEBI ID CHEBI:79735
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H26O3
Net Charge 0
Average Mass 314.41860
Monoisotopic Mass 314.18819
InChI InChI=1S/C20H26O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18+,19+,20+/m1/s1
InChIKey QAHOQNJVHDHYRN-SLHNCBLASA-N
SMILES CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing beta-Estradiol 17-acetate (CHEBI:79735) is a steroid ester (CHEBI:47880)
Synonyms Sources
17beta-Acetylestradiol KEGG COMPOUND
Estra-1,3,5(10)-triene-3,17beta-diol 17-acetate KEGG COMPOUND
Manual Xref Database
C15228 KEGG COMPOUND
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