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Substance Name: DL-Aspartic acid, N-(3-carboxy-1-oxo-3-sulfopropyl)-N-(3-(decyloxy)propyl)-, 1,4-diethyl ester, disodium salt
RN: 35850-79-4
InChIKey: PFPILGLOAUBLMG-OAQMNXJYSA-L

Molecular Formula

  • C25-H43-N-O11-S.2Na

Molecular Weight

  • 611.657
 
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Names and Synonyms

Synonym

  • SV 1147

Systematic Name

  • DL-Aspartic acid, N-(3-carboxy-1-oxo-3-sulfopropyl)-N-(3-(decyloxy)propyl)-, 1,4-diethyl ester, disodium salt

Registry Numbers

CAS Registry Number

  • 35850-79-4

System Generated Number

  • 0035850794

Molecular Formulas

Molecular Formula

  • C25-H43-N-O11-S.2Na

Molecular Formula Fragments

  • C25-H43-N-O11-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C25H45NO11S.2Na/c1-4-7-8-9-10-11-12-13-16-35-17-14-15-26(22(27)19-21(24(29)30)38(32,33)34)20(25(31)37-6-3)18-23(28)36-5-2;;/h20-21H,4-19H2,1-3H3,(H,29,30)(H,32,33,34);;/q;2*+1/p-2/t20-,21?;;/m0../s1

InChIKey

PFPILGLOAUBLMG-OAQMNXJYSA-L

Smiles

[Na+].[Na+].C([C@@H](N(CCCOCCCCCCCCCC)C(C[C@@H](S(=O)(=O)[O-])C(=O)[O-])=O)CC(=O)OCC)(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 6800mg/kg (6800mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 35(2), Pg. 42, 1991.
rat LD50 oral 16200mg/kg (16200mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 35(2), Pg. 42, 1991.