CHEBI:45496 - 11α-hydroxyprogesterone hemisuccinate

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ChEBI Name 11α-hydroxyprogesterone hemisuccinate
ChEBI ID CHEBI:45496
ChEBI ASCII Name 11alpha-hydroxyprogesterone hemisuccinate
Definition A steroid ester that is the O-succinoyl derivative of 11α-hydroxyprogesterone.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H34O6
Net Charge 0
Average Mass 430.53390
Monoisotopic Mass 430.23554
InChI InChI=1S/C25H34O6/c1-14(26)18-6-7-19-17-5-4-15-12-16(27)10-11-24(15,2)23(17)20(13-25(18,19)3)31-22(30)9-8-21(28)29/h12,17-20,23H,4-11,13H2,1-3H3,(H,28,29)/t17-,18+,19-,20+,23+,24-,25+/m0/s1
InChIKey JBBNFGYRYNBDIH-DBGGZKJISA-N
SMILES [H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@@H](C[C@]1(C)[C@H](CC[C@@]21[H])C(C)=O)OC(=O)CCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) has functional parent 11α-hydroxyprogesterone (CHEBI:16076)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) has functional parent succinic acid (CHEBI:15741)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) is a 20-oxo steroid (CHEBI:36885)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) is a 3-oxo-Δ4 steroid (CHEBI:47909)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) is a dicarboxylic acid monoester (CHEBI:36244)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) is a hemisuccinate (CHEBI:138979)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) is a steroid ester (CHEBI:47880)
Incoming 11α-hydroxyprogesterone hemisuccinoyl group (CHEBI:62093) is substituent group from 11α-hydroxyprogesterone hemisuccinate (CHEBI:45496)
IUPAC Name
4-{[(11α)-3,20-dioxopregn-4-en-11-yl]oxy}-4-oxobutanoic acid
Synonyms Sources
11α-hemisuccinylprogesterone ChemIDplus
11α-hydroxy-4-pregnene-3,20-dione-11-hemisuccinate ChemIDplus
11α-hydroxyprogesterone succinate ChEBI
P4-11α-hemisuccinate ChEBI
P4-11α-HS ChEBI
progesterone 11-hemisuccinate ChemIDplus
PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE PDBeChem
progesterone-11α-hemisuccinate ChEBI
Manual Xrefs Databases
DB08547 DrugBank
SIH PDBeChem
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Registry Numbers Types Sources
5160438 Reaxys Registry Number Reaxys
62624-72-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18791859 PubMed citation Europe PMC
1908822 PubMed citation Europe PMC
2428138 PubMed citation Europe PMC
3254631 PubMed citation Europe PMC
7057905 PubMed citation Europe PMC
725976 PubMed citation Europe PMC
8496956 PubMed citation Europe PMC
Last Modified
09 November 2017