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CHEBI:137063 - cholestanol 7α,8α-epoxide
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ChEBI Name
cholestanol 7α,8α-epoxide
ChEBI ID
CHEBI:137063
ChEBI ASCII Name
cholestanol 7alpha,8alpha-epoxide
Definition
A cholestanoid that is lathosterol in which the double bond at position 7,8 has been oxidised to the corresponding epoxide (the 7α,8α stereoisomer).
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
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Formula
C27H46O2
Net Charge
0
Average Mass
402.654
Monoisotopic Mass
402.34978
InChI
InChI=1S/C27H46O2/c1-
17(2)
7-
6-
8-
18(3)
21-
9-
10-
22-
26(21,5)
14-
12-
23-
25(4)
13-
11-
20(28)
15-
19(25)
16-
24-
27(22,23)
29-
24/h17-
24,28H,6-
16H2,1-
5H3/t18-
,19-
,20+,21-
,22-
,23-
,24-
,25+,26-
,27+/m1/s1
InChIKey
JUEGMZBKIWIYAP-JGSBZTSISA-N
SMILES
C1[C@@]
2([C@]
3(CC[C@]
4([C@]
([C@@]
35[C@@H]
(C[C@]
2(C[C@H]
(C1)
O)
[H]
)
O5)
(CC[C@@]
4([C@@H]
(CCCC(C)
C)
C)
[H]
)
[H]
)
C)
[H]
)
C
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cholestanol 7α,8α-epoxide (
CHEBI:137063
)
has functional parent
5α-cholest-7-en-3β-ol (
CHEBI:17168
)
cholestanol 7α,8α-epoxide (
CHEBI:137063
)
has role
human metabolite (
CHEBI:77746
)
cholestanol 7α,8α-epoxide (
CHEBI:137063
)
is a
3β-hydroxy steroid (
CHEBI:36836
)
cholestanol 7α,8α-epoxide (
CHEBI:137063
)
is a
cholestanoid (
CHEBI:50401
)
cholestanol 7α,8α-epoxide (
CHEBI:137063
)
is a
epoxy steroid (
CHEBI:145217
)
IUPAC Name
7α,8α-epoxy-5α-cholestan-3α-ol
Synonyms
Sources
(3β,5α,7α,8α)-7,8-epoxycholestan-3-ol
IUPAC
7α,8α-epoxy-5α-cholestan-3β-ol
UniProt
7α,8α-epoxy-cholestanol
SUBMITTER
Registry Number
Type
Source
5964874
Reaxys Registry Number
Reaxys
Citation
Type
Source
21813643
PubMed citation
SUBMITTER
Last Modified
28 October 2019