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CHEBI:60297 - testosterone 3-(O-carboxymethyl)oxime

ChEBI IDCHEBI:60297
ChEBI Nametestosterone 3-(O-carboxymethyl)oxime
Stars
ASCII Nametestosterone 3-(O-carboxymethyl)oxime
DefinitionThe oxime O-ether formed from testosterone and (aminooxy)acetic acid.
Last Modified11 May 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC21H31NO4
Net Charge0
Average Mass361.482
Monoisotopic Mass361.22531
SMILES[H][C@@]12CCC3=CC(=NOCC(=O)O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H]
InChIInChI=1S/C21H31NO4/c1-20-9-7-14(22-26-12-19(24)25)11-13(20)3-4-15-16-5-6-18(23)21(16,2)10-8-17(15)20/h11,15-18,23H,3-10,12H2,1-2H3,(H,24,25)/t15-,16-,17-,18-,20-,21-/m0/s1
InChIKeyVDYLVWGBLQNNAW-ZKHIMWLXSA-N
ChEBI Ontology
Outgoing Relation(s)
testosterone 3-(O-carboxymethyl)oxime (CHEBI:60297) has functional parent testosterone (CHEBI:17347)
testosterone 3-(O-carboxymethyl)oxime (CHEBI:60297) is a oxime O-ether (CHEBI:36816)
Incoming Relation(s)
testosterone (E)-3-(O-carboxymethyl)oxime (CHEBI:60293) is a testosterone 3-(O-carboxymethyl)oxime (CHEBI:60297)
testosterone (Z)-3-(O-carboxymethyl)oxime (CHEBI:60294) is a testosterone 3-(O-carboxymethyl)oxime (CHEBI:60297)
IUPAC Name 
{[(17β-hydroxyandrost-4-en-3-ylidene)amino]oxy}acetic acid
Synonyms  Source
testosterone-3-CMOChEBI
testosterone 3-(O-(carboxymethyl)oxime)ChemIDplus
CMO-testosteroneChEBI
Registry NumbersSources
Reaxys:2227100Reaxys
CAS:10190-93-9ChemIDplus
Citations