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Substance Name: Acromelic acid A
RN: 86630-09-3
UNII: MDU5184Y3C
InChIKey: CWXNEBSQRIECMV-PJKMHFRUSA-N

Note

  • Isolated from poisonous mushroom Clitocybe acromelaga.

Molecular Formula

  • C13-H14-N2-O7

Molecular Weight

  • 310.2606
 
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Names and Synonyms

Name of Substance

  • Acromelic acid A

Synonym

  • UNII-MDU5184Y3C

Systematic Names

  • 2-Pyridinecarboxylic acid, 5-((3S,4S,5S)-5-carboxy-4-(carboxymethyl)-3-pyrrolidinyl)-1,6-dihydro-6-oxo-
  • 2-Pyridinecarboxylic acid, 5-(5-carboxy-4-(carboxymethyl)-3-pyrrolidinyl)-1,6-dihydro-6-oxo-, (3S-(3alpha,4alpha,5beta))-

Registry Numbers

CAS Registry Number

  • 86630-09-3

FDA UNII

  • MDU5184Y3C

System Generated Number

  • 0086630093

Structure Descriptors

InChI

1S/C13H14N2O7/c16-9(17)3-6-7(4-14-10(6)13(21)22)5-1-2-8(12(19)20)15-11(5)18/h1-2,6-7,10,14H,3-4H2,(H,15,18)(H,16,17)(H,19,20)(H,21,22)/t6-,7+,10-/m0/s1

InChIKey

CWXNEBSQRIECMV-PJKMHFRUSA-N

Smiles

OC(=O)C[C@@H]1[C@H](NC[C@@H]1C2=CC=C(NC2=O)C(=O)O)C(=O)O