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CHEBI:15938 - pregnan-21-ol

ChEBI IDCHEBI:15938
ChEBI Namepregnan-21-ol
Stars
Secondary ChEBI IDsCHEBI:8385, CHEBI:14880, CHEBI:26231
Last Modified13 November 2017
DownloadsMolfile
FormulaC21H36O
Net Charge0
Average Mass304.518
Monoisotopic Mass304.27662
SMILES[H][C@@]12CCC3CCCC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](CCO)CC[C@@]21[H]
InChIInChI=1S/C21H36O/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/h15-19,22H,3-14H2,1-2H3/t15?,16-,17+,18+,19+,20+,21-/m1/s1
InChIKeyDBMUNIJZUYVPCQ-XFNFOBRPSA-N
ChEBI Ontology
Outgoing Relation(s)
pregnan-21-ol (CHEBI:15938) has parent hydride pregnane (CHEBI:8386)
pregnan-21-ol (CHEBI:15938) is a 21-hydroxy steroid (CHEBI:35344)
pregnan-21-ol (CHEBI:15938) is a C21-steroid (CHEBI:61313)
IUPAC Name 
pregnan-21-ol
Synonyms  Source
5-beta-Pregnan-21-olKEGG COMPOUND
Pregnan-21-olKEGG COMPOUND
UniProt Name  Source
pregnan-21-olUniProt
Manual XrefsDatabases
C00892KEGG COMPOUND