CHEBI:32190 - Temocapril hydrochloride

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ChEBI Name Temocapril hydrochloride
ChEBI ID CHEBI:32190
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C23H28N2O5S2.HCl
C23H29ClN2O5S2
Net Charge 0
Average Mass 513.073
Monoisotopic Mass 512.12064
InChI InChI=1S/C23H28N2O5S2.ClH/c1-2-30-23(29)17(11-10-16-7-4-3-5-8-16)24-18-15-32-20(19-9-6-12-31-19)13-25(22(18)28)14-21(26)27;/h3-9,12,17-18,20,24H,2,10-11,13-15H2,1H3,(H,26,27);1H/t17-,18-,20-;/m0./s1
InChIKey XDDQNOKKZKHBIX-ASBZXGSUSA-N
SMILES S1C=CC=C1[C@H]2SC[C@H](N[C@@H](CCC3=CC=CC=C3)C(=O)OCC)C(N(C2)CC(=O)O)=O.Cl
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Temocapril hydrochloride (CHEBI:32190) is a dipeptide (CHEBI:46761)
Synonym Source
Temocapril hydrochloride KEGG COMPOUND
Manual Xref Database
D01119 KEGG DRUG
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Registry Number Type Source
110221-44-8 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017