CHEBI:31740 - Kad 1229

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Kad 1229
ChEBI ID CHEBI:31740
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula 2C19H24NO3.Ca
Net Charge 0
Average Mass 668.888
Monoisotopic Mass 668.31383
InChI InChI=1S/2C19H25NO3.Ca/c2*21-18(20-12-15-8-4-5-9-16(15)13-20)11-17(19(22)23)10-14-6-2-1-3-7-14;/h2*1-3,6-7,15-17H,4-5,8-13H2,(H,22,23);/q;;+2/p-2/t2*15-,16+,17-;/m00./s1
InChIKey PMRVFZXOCRHXFE-FMEJWYFOSA-L
SMILES N1(C(=O)C[C@@H](C([O-])=O)CC2=CC=CC=C2)C[C@]3([H])[C@@]([H])(CCCC3)C1.[Ca+2].N4(C(=O)C[C@@H](C([O-])=O)CC5=CC=CC=C5)C[C@]6([H])[C@@]([H])(CCCC6)C4
ChEBI Ontology
Outgoing Kad 1229 (CHEBI:31740) is a polymer (CHEBI:60027)
Synonyms Sources
Kad 1229 KEGG COMPOUND
Mitiglinide calcium KEGG COMPOUND
Manual Xref Database
C13326 KEGG COMPOUND
View more database links
Registry Number Type Source
145525-41-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014