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Substance Name: Calcium di-L-tryptophanate
RN: 71720-54-2
InChIKey: AJFVCQXKEUTYCR-NAWJVIAPSA-L

Molecular Formula

  • C11-H12-N2-O2.1/2Ca

Molecular Weight

  • 446.5178
 
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Names and Synonyms

Synonym

  • EINECS 275-903-8

Systematic Name

  • Calcium di-L-tryptophanate

Registry Numbers

CAS Registry Number

  • 71720-54-2

System Generated Number

  • 0071720542

Molecular Formulas

Molecular Formula

  • C11-H12-N2-O2.1/2Ca

Molecular Formula Fragments

  • C11-H12-N2-O2
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C11H12N2O2.Ca/c2*12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;/h2*1-4,6,9,13H,5,12H2,(H,14,15);/q;;+2/p-2/t2*9-;/m00./s1

InChIKey

AJFVCQXKEUTYCR-NAWJVIAPSA-L

Smiles

c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)[O-])N.c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)[O-])N.[Ca+2]