CHEBI:35000 - Testosterone decanoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Testosterone decanoate
ChEBI ID CHEBI:35000
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H46O3
Net Charge 0
Average Mass 442.675
Monoisotopic Mass 442.34470
InChI InChI=1S/C29H46O3/c1-4-5-6-7-8-9-10-11-27(31)32-26-15-14-24-23-13-12-21-20-22(30)16-18-28(21,2)25(23)17-19-29(24,26)3/h20,23-26H,4-19H2,1-3H3/t23-,24-,25-,26-,28-,29-/m0/s1
InChIKey LBERVHLCXUMDOT-MPZZESAYSA-N
SMILES CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing Testosterone decanoate (CHEBI:35000) is a steroid ester (CHEBI:47880)
Synonyms Sources
17beta-Hydroxyandrost-4-en-3-one decanoate KEGG COMPOUND
Testosterone decanoate KEGG COMPOUND
Manual Xrefs Databases
C14607 KEGG COMPOUND
D08573 KEGG DRUG
View more database links
Registry Number Type Source
5721-91-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014