CHEBI:28344 - 5,6β-epoxy-5α-cholestan-3β-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5,6β-epoxy-5α-cholestan-3β-ol
ChEBI ID CHEBI:28344
ChEBI ASCII Name 5,6beta-epoxy-5alpha-cholestan-3beta-ol
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3661, CHEBI:23206
Supplier Information
Download Molfile XML SDF
Formula C27H46O2
Net Charge 0
Average Mass 402.65294
Monoisotopic Mass 402.34978
InChI InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1
InChIKey PRYIJAGAEJZDBO-RUXQDQFYSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H]4O[C@@]44C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
ChEBI Ontology
Outgoing 5,6β-epoxy-5α-cholestan-3β-ol (CHEBI:28344) has parent hydride 5α-cholestane (CHEBI:35515)
5,6β-epoxy-5α-cholestan-3β-ol (CHEBI:28344) is a 3β-hydroxy steroid (CHEBI:36836)
5,6β-epoxy-5α-cholestan-3β-ol (CHEBI:28344) is a epoxide (CHEBI:32955)
IUPAC Name
5,6β-epoxy-5α-cholestan-3β-ol
Synonyms Sources
5alpha,6beta-Epoxycholestan-3beta-ol KEGG COMPOUND
Cholesterol-5alpha,6beta-epoxide KEGG COMPOUND
Manual Xref Database
C05419 KEGG COMPOUND
View more database links
Registry Number Type Source
114246-94-5 CAS Registry Number KEGG COMPOUND
Last Modified
19 December 2007