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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:35515 - 5α-cholestane
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ChEBI Ontology
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ChEBI Name
5α-cholestane
ChEBI ID
CHEBI:35515
ChEBI ASCII Name
5alpha-cholestane
Definition
The 5α-stereoisomer of cholestane.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:20650
Supplier Information
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Formula
C27H48
Net Charge
0
Average Mass
372.67002
Monoisotopic Mass
372.37560
InChI
InChI=1S/C27H48/c1-
19(2)
9-
8-
10-
20(3)
23-
14-
15-
24-
22-
13-
12-
21-
11-
6-
7-
17-
26(21,4)
25(22)
16-
18-
27(23,24)
5/h19-
25H,6-
18H2,1-
5H3/t20-
,21-
,22+,23-
,24+,25+,26+,27-
/m1/s1
InChIKey
XIIAYQZJNBULGD-XWLABEFZSA-N
SMILES
[H][C@]12CCCC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])CC2)[C@H](C)CCCC(C)C
ChEBI Ontology
Outgoing
5α-cholestane (
CHEBI:35515
)
is a
cholestane (
CHEBI:35516
)
Incoming
(5α)-cholestan-3β-ol (
CHEBI:86570
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
26,27-dehydrozymosterol (
CHEBI:136770
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
3β-hydroxy-4α-methyl-5α-cholest-7-ene-4β-carboxylic acid (
CHEBI:20244
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
3β-hydroxy-4β-methyl-5α-cholest-7-ene-4α-carboxylic acid (
CHEBI:18134
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
4α-methyllathosterone (
CHEBI:16495
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
4,4-dimethyl-5α-cholesta-8,14,24-trien-3β-ol (
CHEBI:17813
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholest-7-ene (
CHEBI:35865
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholest-8-en-3β-ol (
CHEBI:16608
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholesta-7,24-dien-3β-ol (
CHEBI:16290
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholesta-8,14-dien-3β-ol (
CHEBI:86131
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholestan-3-one (
CHEBI:17762
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholestane-3β,5,6β-triol (
CHEBI:28082
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5α-cholestane-5,6β-diol (
CHEBI:27556
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5,6α-epoxy-5α-cholestan-3β-ol (
CHEBI:49305
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5,6α-epoxy-5α-cholestane (
CHEBI:27634
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
5,6β-epoxy-5α-cholestan-3β-ol (
CHEBI:28344
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
eurysterol A (
CHEBI:65888
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
eurysterol A sulfonic acid (
CHEBI:68591
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
eurysterol B (
CHEBI:65889
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
eurysterol B sulfonic acid (
CHEBI:68594
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
fusidic acid (
CHEBI:29013
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
methyl spongoate (
CHEBI:68388
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
zymosterol (
CHEBI:18252
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
zymosterol intermediate 2 (
CHEBI:52386
)
has parent hydride
5α-cholestane (
CHEBI:35515
)
epidihydrocholesterin (
CHEBI:31542
)
is a
5α-cholestane (
CHEBI:35515
)
IUPAC Name
5α-cholestane
Synonyms
Sources
(5α)-cholestane
NIST Chemistry WebBook
α-cholestane
NIST Chemistry WebBook
Manual Xref
Database
HMDB0041632
HMDB
View more database links
Registry Numbers
Types
Sources
2051806
Reaxys Registry Number
Reaxys
481-21-0
CAS Registry Number
ChemIDplus
481-21-0
CAS Registry Number
NIST Chemistry WebBook
Last Modified
14 March 2018