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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:78600 - 11-dehydrocorticosterone
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ChEBI Ontology
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ChEBI Name
11-dehydrocorticosterone
ChEBI ID
CHEBI:78600
Definition
An 11-oxo steroid that is corticosterone in which the hydroxy substituent at the 11β position has been oxidised to give the corresponding ketone.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Lucila Aimo
Secondary ChEBI IDs
CHEBI:711
Supplier Information
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Formula
C21H28O4
Net Charge
0
Average Mass
344.44460
Monoisotopic Mass
344.19876
InChI
InChI=1S/C21H28O4/c1-
20-
8-
7-
13(23)
9-
12(20)
3-
4-
14-
15-
5-
6-
16(18(25)
11-
22)
21(15,2)
10-
17(24)
19(14)
20/h9,14-
16,19,22H,3-
8,10-
11H2,1-
2H3/t14-
,15-
,16+,19+,20-
,21-
/m0/s1
InChIKey
FUFLCEKSBBHCMO-KJQYFISQSA-N
SMILES
C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Roles Classification
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
11-dehydrocorticosterone (
CHEBI:78600
)
has functional parent
corticosterone (
CHEBI:16827
)
11-dehydrocorticosterone (
CHEBI:78600
)
has role
human metabolite (
CHEBI:77746
)
11-dehydrocorticosterone (
CHEBI:78600
)
has role
mouse metabolite (
CHEBI:75771
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
11-oxo steroid (
CHEBI:47787
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
20-oxo steroid (
CHEBI:36885
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
21-hydroxy steroid (
CHEBI:35344
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
3-oxo-Δ
4
steroid (
CHEBI:47909
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
corticosteroid (
CHEBI:50858
)
11-dehydrocorticosterone (
CHEBI:78600
)
is a
primary α-hydroxy ketone (
CHEBI:139590
)
Synonyms
Sources
11-dehydrocorticosterone
UniProt
11-DHC
ChEBI
11-oxo-11-deoxycorticosterone
ChemIDplus
17-(1-keto-2-hydroxyethyl)-Δ
4
androsten-3,11-dione
ChEBI
17-deoxycortisone
ChemIDplus
4-pregnen-21-ol- 3,11,20-trione
SUBMITTER
dehydrocorticosterone
ChemIDplus
Δ
4
-pregnen-21-ol-3,11,20-trione
ChEBI
Kendall's compound A
ChemIDplus
Manual Xrefs
Databases
C05490
KEGG COMPOUND
HMDB0004029
HMDB
LMST02030192
LIPID MAPS
US2778776
Patent
View more database links
Registry Numbers
Types
Sources
3108660
Reaxys Registry Number
Reaxys
72-23-1
CAS Registry Number
KEGG COMPOUND
72-23-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
11751610
PubMed citation
Europe PMC
17329828
PubMed citation
Europe PMC
17389675
PubMed citation
Europe PMC
1951719
PubMed citation
Europe PMC
23832962
PubMed citation
Europe PMC
4295227
PubMed citation
Europe PMC
8430442
PubMed citation
Europe PMC
8498539
PubMed citation
Europe PMC
8613810
PubMed citation
Europe PMC
Last Modified
06 February 2018