rel-(3aR,6R,6aR)-Hexahydro-3-oxo-2H-pyrrolo[3,4-d]isoxazole-6-carboxylic acid

CAS Registry Number®

227619-65-0
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CAS Name

rel-(3aR,6R,6aR)-Hexahydro-3-oxo-2H-pyrrolo[3,4-d]isoxazole-6-carboxylic acid

Molecular Formula

C6H8N2O4

Molecular Mass

172.14

Cite this Page

rel-(3aR,6R,6aR)-Hexahydro-3-oxo-2H-pyrrolo[3,4-d]isoxazole-6-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=227619-65-0 (retrieved 2024-06-26) (CAS RN: 227619-65-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C6H8N2O4/c9-5-2-1-7-3(6(10)11)4(2)12-8-5/h2-4,7H,1H2,(H,8,9)(H,10,11)/t2-,3-,4-/s2

InChIKey

InChIKey=IOOKKDXVJPSSSC-BWNNCEEONA-N

SMILES

C(O)(=O)[C@@H]1[C@@]2([C@@](C(=O)NO2)(CN1)[H])[H]

Canonical SMILES

O=C(O)C1NCC2C(=O)NOC12

Other Names for this Substance

  • 2H-Pyrrolo[3,4-d]isoxazole-6-carboxylic acid, hexahydro-3-oxo-, (3aR,6R,6aR)-rel-
  • rel-(3aR,6R,6aR)-Hexahydro-3-oxo-2H-pyrrolo[3,4-d]isoxazole-6-carboxylic acid