L-Homocysteine, (3S)-3-amino-3-carboxy-1-propanesulfonate (ester)

CAS Registry Number®

59729-28-1
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CAS Name

L-Homocysteine, (3S)-3-amino-3-carboxy-1-propanesulfonate (ester)

Molecular Formula

C8H16N2O6S2

Molecular Mass

300.35

Cite this Page

L-Homocysteine, (3S)-3-amino-3-carboxy-1-propanesulfonate (ester).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59729-28-1 (retrieved 2024-09-20) (CAS RN: 59729-28-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H16N2O6S2/c9-5(7(11)12)1-3-17-18(15,16)4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1

InChIKey

InChIKey=RAWHLRBPOKUFNQ-WDSKDSINSA-N

SMILES

C(S(SCC[C@@H](C(O)=O)N)(=O)=O)C[C@@H](C(O)=O)N

Canonical SMILES

O=C(O)C(N)CCSS(=O)(=O)CCC(N)C(=O)O

Other Names for this Substance

  • L-Homocysteine, (3S)-3-amino-3-carboxy-1-propanesulfonate (ester)
  • L-Homocysteine, 3-amino-3-carboxy-1-propanesulfonate (ester), (S)-
  • L-Homocystine sulfone

Deleted or Replaced CAS Registry Numbers

3860-79-5