CHEBI:135704 - sivelestat

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ChEBI Name sivelestat
ChEBI ID CHEBI:135704
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H22N2O7S
Net Charge 0
Average Mass 434.465
Monoisotopic Mass 434.11477
InChI InChI=1S/C20H22N2O7S/c1-20(2,3)19(26)29-13-8-10-14(11-9-13)30(27,28)22-16-7-5-4-6-15(16)18(25)21-12-17(23)24/h4-11,22H,12H2,1-3H3,(H,21,25)(H,23,24)
InChIKey BTGNGJJLZOIYID-UHFFFAOYSA-N
SMILES C(NCC(O)=O)(=O)C1=C(NS(=O)(=O)C2=CC=C(C=C2)OC(C(C)(C)C)=O)C=CC=C1
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 sivelestat (CHEBI:135704) has functional parent N-benzoylglycine (CHEBI:18089)
sivelestat (CHEBI:135704) is a N-acylglycine (CHEBI:16180)
sivelestat (CHEBI:135704) is a pivalate ester (CHEBI:50784)
Manual Xref Database
2452 DrugCentral
View more database links
Registry Number Type Source
127373-66-4 CAS Registry Number DrugCentral
Last Modified
31 March 2017