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Substance Name: Atiglai
RN: 131432-97-8
InChIKey: WJWNHNINOVANSJ-ZEYWSJKMSA-N

Molecular Formula

  • C19-H33-N5-O9.C2-H-F3-O2

Molecular Weight

  • 589.518
 
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Names and Synonyms

Results Name

  • Atiglai

Name of Substance

  • N-(2-O-(2-Acetamido-1,2,3,5-tetradeoxy-1,5-iminoglucitol-3-yl)lactoyl)alanyl-isoglutamine

Synonyms

  • (2R-(2alpha,3beta,4alpha(R*),5beta))-N2-(N-(2-((5-(Acetylamino)-3-hydroxy-2-(hydroxymethyl)-4-piperidinyl)oxy)-1-oxopropyl)-L-alanyl)-D-alpha-glutamine
  • Atiglai
  • N-(2-O-(2-Acetamido-1,2,3,5-tetradeoxy-1,5-imino-D-glucitol-3-yl)-D-lactoyl)-L-alanyl-D-isoglutamine
  • N2-(N-(2-((5-(Acetylamino)-3-hydroxy-2-(hydroxymethyl)-4-piperidinyl)oxy)-1-oxopropyl)-L-alanyl)-D-alpha-Glutamine (2R-(2alpha,3beta,4alpha(R*),5beta))-, mono(trifluoroacetate) (salt)

Systematic Name

  • D-alpha-Glutamine, N2-(N-(2-((5-(acetylamino)-3-hydroxy-2-(hydroxymethyl)-4-piperidinyl)oxy)-1-oxopropyl)-L-alanyl)-, (2R-(2alpha,3beta,4alpha(R*),5beta))-, mono(trifluoroacetate) (salt)

Registry Numbers

CAS Registry Number

  • 131432-97-8

System Generated Number

  • 0131432978

Molecular Formulas

Molecular Formula

  • C19-H33-N5-O9.C2-H-F3-O2

Molecular Formula Fragments

  • C19-H33-N5-O9
  • C2-H-F3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C19H33N5O9.C2HF3O2/c1-8(17(29)24-11(19(31)32)4-5-14(20)27)22-18(30)9(2)33-16-12(23-10(3)26)6-21-13(7-25)15(16)28;3-2(4,5)1(6)7/h8-9,11-13,15-16,21,25,28H,4-7H2,1-3H3,(H2,20,27)(H,22,30)(H,23,26)(H,24,29)(H,31,32);(H,6,7)/t8-,9+,11+,12-,13?,15+,16+;/m0./s1

InChIKey

WJWNHNINOVANSJ-ZEYWSJKMSA-N

Smiles

C(=O)(O)[C@H](NC([C@@H](NC([C@@H](C)O[C@H]1[C@@H]([C@@H](NC[C@@H]1NC(=O)C)CO)O)=O)C)=O)CCC(N)=O.C(C(F)(F)F)(=O)O