CHEBI:17934 - pregnan-21-al

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pregnan-21-al
ChEBI ID CHEBI:17934
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:8384, CHEBI:14879, CHEBI:26230
Supplier Information
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Formula C21H34O
Net Charge 0
Average Mass 302.49406
Monoisotopic Mass 302.26097
InChI InChI=1S/C21H34O/c1-20-12-4-3-5-15(20)6-8-17-18-9-7-16(11-14-22)21(18,2)13-10-19(17)20/h14-19H,3-13H2,1-2H3/t15?,16-,17+,18+,19+,20+,21-/m1/s1
InChIKey UJWPMRYSXHLYMB-XFNFOBRPSA-N
SMILES [H][C@@]12CCC3CCCC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])CC=O
ChEBI Ontology
Outgoing pregnan-21-al (CHEBI:17934) has parent hydride pregnane (CHEBI:8386)
pregnan-21-al (CHEBI:17934) is a 21-oxo steroid (CHEBI:36886)
pregnan-21-al (CHEBI:17934) is a C21-steroid (CHEBI:61313)
pregnan-21-al (CHEBI:17934) is a steroid aldehyde (CHEBI:131565)
IUPAC Name
pregnan-21-al
Synonyms Sources
Pregnan-21-al KEGG COMPOUND
pregnan-21-al UniProt
Manual Xref Database
C00891 KEGG COMPOUND
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Last Modified
13 November 2017