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> Main
CHEBI:52023 - hyodeoxycholic acid
Main
ChEBI Ontology
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ChEBI Name
hyodeoxycholic acid
ChEBI ID
CHEBI:52023
Definition
A member of the class of 5β-cholanic acids that is (5β)-cholan-24-oic acid substituted by α-hydroxy groups at positions 3 and 6.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
Download
Molfile
XML
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Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Wikipedia
License
Read full article at Wikipedia
Formula
C24H40O4
Net Charge
0
Average Mass
392.57200
Monoisotopic Mass
392.29266
InChI
InChI=1S/C24H40O4/c1-
14(4-
7-
22(27)
28)
17-
5-
6-
18-
16-
13-
21(26)
20-
12-
15(25)
8-
10-
24(20,3)
19(16)
9-
11-
23(17,18)
2/h14-
21,25-
26H,4-
13H2,1-
3H3,(H,27,28)
/t14-
,15-
,16+,17-
,18+,19+,20+,21+,23-
,24-
/m1/s1
InChIKey
DGABKXLVXPYZII-SIBKNCMHSA-N
SMILES
[H]
[C@@]
1(CC[C@@]
2([H]
)
[C@]
3([H]
)
C[C@H]
(O)
[C@]
4([H]
)
C[C@H]
(O)
CC[C@]
4(C)
[C@@]
3([H]
)
CC[C@]
12C)
[C@H]
(C)
CCC(O)
=O
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in blood serum
(BTO:0000133)
. See:
MetaboLights Study
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
hyodeoxycholic acid (
CHEBI:52023
)
has functional parent
cholic acid (
CHEBI:16359
)
hyodeoxycholic acid (
CHEBI:52023
)
has role
human metabolite (
CHEBI:77746
)
hyodeoxycholic acid (
CHEBI:52023
)
has role
mouse metabolite (
CHEBI:75771
)
hyodeoxycholic acid (
CHEBI:52023
)
is a
5β-cholanic acids (
CHEBI:36248
)
hyodeoxycholic acid (
CHEBI:52023
)
is a
6α,20ξ-murideoxycholic acid (
CHEBI:363227
)
hyodeoxycholic acid (
CHEBI:52023
)
is a
bile acid (
CHEBI:3098
)
hyodeoxycholic acid (
CHEBI:52023
)
is a
C
24
-steroid (
CHEBI:131620
)
hyodeoxycholic acid (
CHEBI:52023
)
is conjugate acid of
hyodeoxycholate (
CHEBI:58875
)
Incoming
hyodeoxycholic acid 24-
O
-(β-
D
-glucuronide) (
CHEBI:137812
)
has functional parent
hyodeoxycholic acid (
CHEBI:52023
)
hyodeoxycholic acid 6-
O
-(β-
D
-glucuronide) (
CHEBI:137822
)
has functional parent
hyodeoxycholic acid (
CHEBI:52023
)
hyodeoxycholate (
CHEBI:58875
)
is conjugate base of
hyodeoxycholic acid (
CHEBI:52023
)
IUPAC Name
3α,6α-dihydroxy-5β-cholan-24-oic acid
Synonyms
Sources
3alpha,6alpha-Dihydroxy-5beta-cholanic acid
SUBMITTER
3alpha,6alpha-Dihydroxy-5beta-cholanic acid
KEGG COMPOUND
6alpha-Hydroxylithocholate
SUBMITTER
6alpha-Hydroxylithocholate
KEGG COMPOUND
7-Deoxyhyocholic acid
ChemIDplus
Hyodesoxycholic acid
ChemIDplus
Hyodesoxycholic acid
KEGG COMPOUND
Iodeoxycholic acid
KEGG COMPOUND
Manual Xrefs
Databases
C00030498
KNApSAcK
C15517
KEGG COMPOUND
CPD-7284
MetaCyc
HMDB0000733
HMDB
Hyodeoxycholic_acid
Wikipedia
LMST04010024
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
3218394
Reaxys Registry Number
Reaxys
83-49-8
CAS Registry Number
ChemIDplus
Citations
Types
Sources
18307294
PubMed citation
Europe PMC
19711910
PubMed citation
Europe PMC
23752203
PubMed citation
Europe PMC
23756265
PubMed citation
Europe PMC
Last Modified
12 July 2017