(2S)-1-[2-[(2S)-2,6-Dicarboxy-2,3-dihydro-4-pyridinyl]ethenyl]-1,2,3,7-tetrahydro-7-oxopyrano[3,4-b]pyrrole-2,5-dicarboxylic acid

CAS Registry Number®

12624-19-0
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CAS Name

(2S)-1-[2-[(2S)-2,6-Dicarboxy-2,3-dihydro-4-pyridinyl]ethenyl]-1,2,3,7-tetrahydro-7-oxopyrano[3,4-b]pyrrole-2,5-dicarboxylic acid

Molecular Formula

C18H14N2O10

Molecular Mass

418.31

Cite this Page

(2S)-1-[2-[(2S)-2,6-Dicarboxy-2,3-dihydro-4-pyridinyl]ethenyl]-1,2,3,7-tetrahydro-7-oxopyrano[3,4-b]pyrrole-2,5-dicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=12624-19-0 (retrieved 2024-09-19) (CAS RN: 12624-19-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H14N2O10/c21-14(22)9-3-7(4-10(19-9)15(23)24)1-2-20-11(16(25)26)5-8-6-12(17(27)28)30-18(29)13(8)20/h1-3,6,10-11H,4-5H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)/t10-,11-/m0/s1

InChIKey

InChIKey=JSTREFIEMNXITL-QWRGUYRKSA-N

SMILES

C(=CC=1C[C@@H](C(O)=O)N=C(C(O)=O)C1)N2C3=C(C[C@H]2C(O)=O)C=C(C(O)=O)OC3=O

Canonical SMILES

O=C(O)C1=NC(C(=O)O)CC(C=CN2C=3C(=O)OC(=CC3CC2C(=O)O)C(=O)O)=C1

Other Names for this Substance

  • Pyrano[3,4-b]pyrrole-2,5-dicarboxylic acid, 1-[2-[(2S)-2,6-dicarboxy-2,3-dihydro-4-pyridinyl]ethenyl]-1,2,3,7-tetrahydro-7-oxo-, (2S)-
  • Pyrano[3,4-b]pyrrole-2,5-dicarboxylic acid, 1-[2-(2,6-dicarboxy-2,3-dihydro-4-pyridinyl)ethenyl]-1,2,3,7-tetrahydro-7-oxo-, [S-(R*,R*)]-
  • (2S)-1-[2-[(2S)-2,6-Dicarboxy-2,3-dihydro-4-pyridinyl]ethenyl]-1,2,3,7-tetrahydro-7-oxopyrano[3,4-b]pyrrole-2,5-dicarboxylic acid
  • Muscapurpurin