CHEBI:79524 - 3beta-(Acetyloxy)-5alpha-androst-16-ene-16-carboxaldehyde

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ChEBI Name 3beta-(Acetyloxy)-5alpha-androst-16-ene-16-carboxaldehyde
ChEBI ID CHEBI:79524
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H32O3
Net Charge 0
Average Mass 344.48770
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-14(24)25-17-6-9-22(3)16(11-17)4-5-18-19(22)7-8-21(2)12-15(13-23)10-20(18)21/h12-13,16-20H,4-11H2,1-3H3/t16-,17-,18+,19-,20-,21+,22-/m0/s1
InChIKey IZJWIBVOSGOTPV-MZLYOWLHSA-N
SMILES CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC(C=O)=C[C@@]4(C)CC[C@H]23)C1
ChEBI Ontology
Outgoing 3beta-(Acetyloxy)-5alpha-androst-16-ene-16-carboxaldehyde (CHEBI:79524) is a steroid aldehyde (CHEBI:131565)
3beta-(Acetyloxy)-5alpha-androst-16-ene-16-carboxaldehyde (CHEBI:79524) is a steroid ester (CHEBI:47880)
Manual Xref Database
C15001 KEGG COMPOUND
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Last Modified
17 March 2016