Anticapsin

CAS Registry Number®

28978-07-6
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CAS Name

Anticapsin

Molecular Formula

C9H13NO4

Molecular Mass

199.20

Cite this Page

Anticapsin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28978-07-6 (retrieved 2024-05-19) (CAS RN: 28978-07-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    240 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H13NO4/c10-5(9(12)13)3-4-1-2-6(11)8-7(4)14-8/h4-5,7-8H,1-3,10H2,(H,12,13)/t4-,5-,7+,8-/m0/s1

InChIKey

InChIKey=KHVZXXWDPSCGEK-MGVQOFIGSA-N

SMILES

C([C@@H](C(O)=O)N)[C@H]1[C@@]2([C@@](O2)(C(=O)CC1)[H])[H]

Canonical SMILES

O=C(O)C(N)CC1CCC(=O)C2OC21

Other Names for this Substance

  • 7-Oxabicyclo[4.1.0]heptane-2-propanoic acid, α-amino-5-oxo-, (αS,1R,2S,6R)-
  • 7-Oxabicyclo[4.1.0]heptane-2-propionic acid, α-amino-5-oxo-, (αS,1R,2S,6R)-
  • 7-Oxabicyclo[4.1.0]heptane-2-propanoic acid, α-amino-5-oxo-, [1R-[1α,2β(S*),6α]]-
  • S,1R,2S,6R)-α-Amino-5-oxo-7-oxabicyclo[4.1.0]heptane-2-propanoic acid
  • Anticapsin

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