Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Caldiamide sodium [USAN:BAN]
RN: 122760-91-2
UNII: 1M6415C70M
InChIKey: FHOBFNOBIIQSOV-UHFFFAOYSA-K

Classification Code

  • Pharmaceutic Aid

Molecular Formula

  • C16-H26-Ca-N5-Na-O8.H2-O

Molecular Weight

  • 497.4912
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Caldiamide sodium [USAN:BAN]

Synonyms

  • Calciate(1-), (5,8-bis(carboxymethyl)-11-(2-(methylamino)-2-oxoethyl)-3-oxo-2,5,8,11-tetraazatridecan-13-oato(3-))-, sodium, hydrate
  • Caldiamide sodium
  • Sodium (N,N-bis(2-((carboxymethyl)((methylcarbamoyl)methyl)amino)ethyl)glycinato(3-))calciate(1-), hydrate
  • UNII-1M6415C70M

Systematic Name

  • Calciate(1-), (5,8-bis(carboxymethyl)-11-(2-methylamino)-2-oxoethyl)-3-oxo-2,5,8,11-tetraazatridecan-13-oato(3-)-, sodium, hydrate

Registry Numbers

CAS Registry Number

  • 122760-91-2

FDA UNII

  • 1M6415C70M

System Generated Number

  • 0122760912

Molecular Formulas

Molecular Formula

  • C16-H26-Ca-N5-Na-O8.H2-O

Molecular Formula Fragments

  • C16-H26-Ca-N5-Na-O8
  • H2-O

Structure Descriptors

InChI

1S/C16H29N5O8.Ca.Na.H2O/c1-17-12(22)7-20(10-15(26)27)5-3-19(9-14(24)25)4-6-21(11-16(28)29)8-13(23)18-2;;;/h3-11H2,1-2H3,(H,17,22)(H,18,23)(H,24,25)(H,26,27)(H,28,29);;;1H2/q;+2;+1;/p-3

InChIKey

FHOBFNOBIIQSOV-UHFFFAOYSA-K

Smiles

CNC(=O)CN(CCN(CCN(CC(=O)NC)CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O.[Na+].[Ca+2]