skip to main content

Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

chemical entity > chemical substance > mixture > polymer > kad 1229

Preferred term

kad 1229  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • 2C19H24NO3.Ca

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

mass

  • 668.888

monoisotopicmass

  • 668.31383

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

subset

  • 2_STAR

synonym EXACT

  • Kad 1229

synonym RELATED

  • Mitiglinide calcium

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:31740

Download this concept:

RDF/XML TURTLE JSON-LD