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> Main
CHEBI:28033 - 5,6β-epoxy-5β-cholestane
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ChEBI Ontology
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ChEBI Name
5,6β-epoxy-5β-cholestane
ChEBI ID
CHEBI:28033
ChEBI ASCII Name
5,6beta-epoxy-5beta-cholestane
Definition
The epoxide formed from cholest-5-ene by formal addition of oxygen across the 5,6 double bond with β-configuration at both C-5 and C-6.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:2005, CHEBI:20518
Supplier Information
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Formula
C27H46O
Net Charge
0
Average Mass
386.65350
Monoisotopic Mass
386.35487
InChI
InChI=1S/C27H46O/c1-
18(2)
9-
8-
10-
19(3)
21-
11-
12-
22-
20-
17-
24-
27(28-
24)
15-
7-
6-
14-
26(27,5)
23(20)
13-
16-
25(21,22)
4/h18-
24H,6-
17H2,1-
5H3/t19-
,20+,21-
,22+,23+,24-
,25-
,26-
,27-
/m1/s1
InChIKey
OJFSRAVBTAGBIM-NBGJRJMZSA-N
SMILES
[H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H]4O[C@]44CCCC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
5,6β-epoxy-5β-cholestane (
CHEBI:28033
)
has parent hydride
5β-cholestane (
CHEBI:35517
)
5,6β-epoxy-5β-cholestane (
CHEBI:28033
)
has role
mouse metabolite (
CHEBI:75771
)
5,6β-epoxy-5β-cholestane (
CHEBI:28033
)
is a
epoxide (
CHEBI:32955
)
IUPAC Name
(5β,6β)-5,6-epoxycholestane
Manual Xref
Database
C05417
KEGG COMPOUND
View more database links
Registry Number
Type
Source
87816
Reaxys Registry Number
Reaxys
Last Modified
27 January 2016