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Substance Name: Prephenyllactate
RN: 117580-15-1
InChIKey: NJHQXJPGTQOYFN-ZMONDCLVSA-N

Note

  • Isolated from Neurospora crassa.

Molecular Formula

  • C10-H12-O6

Molecular Weight

  • 228.1988
 
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Names and Synonyms

Name of Substance

  • Prephenyllactate

Synonym

  • (1-Carboxy-4-hydroxy-2,5-cyclohexadiene-1-yl)lactic acid

Systematic Name

  • 2,5-Cyclohexadiene-1-propanoic acid, 1-carboxy-alpha, 4-dihydroxy-, (1(R)-cis)-

Registry Numbers

CAS Registry Number

  • 117580-15-1

System Generated Number

  • 0117580151

Structure Descriptors

InChI

1S/C10H12O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6-7,11-12H,5H2,(H,13,14)(H,15,16)/t6-,7?,10-

InChIKey

NJHQXJPGTQOYFN-ZMONDCLVSA-N

Smiles

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