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Substance Name: Deoxypyridinoline
RN: 90032-33-0
InChIKey: ZAHDXEIQWWLQQL-RDBSUJKOSA-N

Molecular Formula

  • C18-H28-N4-O7

Molecular Weight

  • 412.44
 
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Names and Synonyms

Name of Substance

  • Deoxypyridinoline

Synonyms

  • Lysylpyridinoline
  • N-(5-Amino-5-carboxypentyl)-3-hydroxy-4-(2-amino-2-carboxyethyl)-5-(3-amino-3-carboxypropyl)pyridine

Systematic Names

  • Pyridinium, 4-((2S)-2-amino-2-carboxyethyl)-1-((5S)-5-amino-5-carboxypentyl)-3-((3S)-3-amino-3-carboxypropyl)-5-hydroxy-, inner salt
  • Pyridinium, 4-(2-amino-2-carboxyethyl)-1-(5-amino-5-carboxypentyl)-3-(3-amino-3-carboxypropyl)-5-hydroxy-, hydroxide, inner salt, stereoisomer

Registry Numbers

CAS Registry Number

  • 90032-33-0

System Generated Number

  • 0090032330

Structure Descriptors

InChI

1S/C18H28N4O7/c19-12(16(24)25)3-1-2-6-22-8-10(4-5-13(20)17(26)27)11(15(23)9-22)7-14(21)18(28)29/h8-9,12-14H,1-7,19-21H2,(H3-,23,24,25,26,27,28,29)/t12-,13+,14+/m1/s1

InChIKey

ZAHDXEIQWWLQQL-RDBSUJKOSA-N

Smiles

c1(CC[C@H](N)C(O)=O)c[n+](cc(c1C[C@@H](C(O)=O)N)O)CCCC[C@H](C([O-])=O)N