CHEBI:135355 - pregnenolone succinate

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ChEBI Name pregnenolone succinate
ChEBI ID CHEBI:135355
Stars This entity has been manually annotated by a third party.
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Formula C25H36O5
Net Charge 0
Average Mass 416.551
Monoisotopic Mass 416.25627
InChI InChI=1S/C25H36O5/c1-15(26)19-6-7-20-18-5-4-16-14-17(30-23(29)9-8-22(27)28)10-12-24(16,2)21(18)11-13-25(19,20)3/h4,17-21H,5-14H2,1-3H3,(H,27,28)/t17-,18-,19+,20-,21-,24-,25+/m0/s1
InChIKey OZZAYJQNMKMUSD-DMISRAGPSA-N
SMILES C[C@@]12[C@@]3([C@]([C@]4([C@@](CC3)(C)[C@H](CC4)C(C)=O)[H])(CC=C1C[C@H](CC2)OC(CCC(O)=O)=O)[H])[H]
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 pregnenolone succinate (CHEBI:135355) is a hemisuccinate (CHEBI:138979)
pregnenolone succinate (CHEBI:135355) is a steroid ester (CHEBI:47880)
Manual Xref Database
2256 DrugCentral
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Registry Number Type Source
4598-67-8 CAS Registry Number DrugCentral
Last Modified
09 November 2017