CHEBI:16973 - 11-deoxycorticosterone

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ChEBI Name 11-deoxycorticosterone
ChEBI ID CHEBI:16973
Definition A mineralocorticoid that is progesterone substituted at position 21 by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:713, CHEBI:39642, CHEBI:11314, CHEBI:19123, CHEBI:86536
Supplier Information ChemicalBook:CB3271542, eMolecules:1970569, eMolecules:481810, Selleckchem:biotin-vitamin-b7, ZINC000035024346
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Formula C21H30O3
Net Charge 0
Average Mass 330.46110
Monoisotopic Mass 330.21949
InChI InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1
InChIKey ZESRJSPZRDMNHY-YFWFAHHUSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)C(=O)CO
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
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).
hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
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ChEBI Ontology
Outgoing 11-deoxycorticosterone (CHEBI:16973) has functional parent progesterone (CHEBI:17026)
11-deoxycorticosterone (CHEBI:16973) has role human metabolite (CHEBI:77746)
11-deoxycorticosterone (CHEBI:16973) has role mouse metabolite (CHEBI:75771)
11-deoxycorticosterone (CHEBI:16973) is a 20-oxo steroid (CHEBI:36885)
11-deoxycorticosterone (CHEBI:16973) is a 21-hydroxy steroid (CHEBI:35344)
11-deoxycorticosterone (CHEBI:16973) is a 3-oxo-Δ4 steroid (CHEBI:47909)
11-deoxycorticosterone (CHEBI:16973) is a mineralocorticoid (CHEBI:25354)
11-deoxycorticosterone (CHEBI:16973) is a primary α-hydroxy ketone (CHEBI:139590)
Incoming 11-deoxycorticosterone-21-hemisuccinate (CHEBI:62112) has functional parent 11-deoxycorticosterone (CHEBI:16973)
5α-dihydrodeoxycorticosterone (CHEBI:81468) has functional parent 11-deoxycorticosterone (CHEBI:16973)
5β-dihydrodeoxycorticosterone (CHEBI:86384) has functional parent 11-deoxycorticosterone (CHEBI:16973)
IUPAC Name
21-hydroxypregn-4-ene-3,20-dione
Synonyms Sources
11-Deoxycorticosterone KEGG COMPOUND
21-Hydroxy-4-pregnene-3,20-dione KEGG COMPOUND
21-hydroxyprogesterone UniProt
21-hydroxyprogesterone ChemIDplus
4-pregnen-21-ol-3,20-dione ChemIDplus
Cortexone KEGG COMPOUND
Deoxycorticosterone KEGG COMPOUND
DESOXYCORTICOSTERONE PDBeChem
Desoxycortone KEGG COMPOUND
desoxycortone ChemIDplus
DOC KEGG COMPOUND
Kendall's desoxy compound B ChemIDplus
Reichstein's substance Q NIST Chemistry WebBook
Manual Xrefs Databases
11-DEOXYCORTICOSTERONE MetaCyc
1CA PDBeChem
820 DrugCentral
C03205 KEGG COMPOUND
D07792 KEGG DRUG
Desoxycorticosterone Wikipedia
LMST02030087 LIPID MAPS
View more database links
Registry Numbers Types Sources
2062123 Reaxys Registry Number Reaxys
64-85-7 CAS Registry Number KEGG COMPOUND
64-85-7 CAS Registry Number ChemIDplus
64-85-7 CAS Registry Number NIST Chemistry WebBook
Citation
Last Modified
16 September 2021