(αS,1α,4α)-α-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid

CAS Registry Number®

53078-86-7

CAS Name

(αS,1α,4α)-α-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid

Molecular Formula

C10H13NO5

Molecular Mass

227.21

Cite this Page

(αS,1α,4α)-α-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=53078-86-7 (retrieved 2024-11-22) (CAS RN: 53078-86-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H13NO5/c11-7(8(13)14)5-10(9(15)16)3-1-6(12)2-4-10/h1-4,6-7,12H,5,11H2,(H,13,14)(H,15,16)/t6-,7-,10+/m0/s1

InChIKey

InChIKey=MIEILDYWGANZNH-MHYGZLNHSA-N

SMILES

C([C@@H](C(O)=O)N)[C@@]1(C(O)=O)C=C[C@H](O)C=C1

Canonical SMILES

O=C(O)C(N)CC1(C=CC(O)C=C1)C(=O)O

Other Names for this Substance

  • 2,5-Cyclohexadiene-1-propanoic acid, α-amino-1-carboxy-4-hydroxy-, (αS,1α,4α)-
  • 2,5-Cyclohexadiene-1-propanoic acid, α-amino-1-carboxy-4-hydroxy-, [1(S)-cis]-
  • (αS,1α,4α)-α-Amino-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1-propanoic acid
  • Pretyrosine
  • Arogenic acid

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