CHEBI:79703 - 5alpha,17alpha-Pregn-2-en-20-yn-17-ol acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5alpha,17alpha-Pregn-2-en-20-yn-17-ol acetate
ChEBI ID CHEBI:79703
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H32O2
Net Charge 0
Average Mass 340.49900
Monoisotopic Mass 340.24023
InChI InChI=1S/C23H32O2/c1-5-23(25-16(2)24)15-12-20-18-10-9-17-8-6-7-13-21(17,3)19(18)11-14-22(20,23)4/h1,6-7,17-20H,8-15H2,2-4H3/t17-,18-,19+,20+,21+,22+,23+/m1/s1
InChIKey SQRBBVVZRKZEPF-OWNQEUAMSA-N
SMILES CC(=O)O[C@]1(CC[C@H]2[C@@H]3CC[C@H]4CC=CC[C@]4(C)[C@H]3CC[C@]12C)C#C
ChEBI Ontology
Outgoing 5alpha,17alpha-Pregn-2-en-20-yn-17-ol acetate (CHEBI:79703) is a steroid ester (CHEBI:47880)
Synonym Source
17alpha-Ethynyl-5alpha-androst-2-en 17beta-acetate KEGG COMPOUND
Manual Xref Database
C15186 KEGG COMPOUND
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Registry Number Type Source
124-85-6 CAS Registry Number KEGG COMPOUND