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Substance Name: Aerocyanidin
RN: 113701-99-8
InChIKey: NYURBVOZXRWAPK-UHFFFAOYSA-N

Note

  • Isolated from Chromobacterium violaceum.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H25-N-O4

Molecular Weight

  • 283.366
 
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Names and Synonyms

Name of Substance

  • Aerocyanidin

Synonyms

  • Aerocyanidin
  • kappa-Hydroxy-3-isocyano-3-methyloxiraneundecanoic acid (2-alpha(R*),3-alpha)-(-)-

Systematic Names

  • Oxiraneundecanoic acid, kappa-hydroxy-3-isocyano-3-methyl-, (2-alpha(R*),3-alpha)-(-)-
  • Oxiraneundecanoic acid, kappa-hydroxy-3-isocyano-3-methyl-, (2alpha(R*),3alpha)-(-)-

Registry Numbers

CAS Registry Number

  • 113701-99-8

System Generated Number

  • 0113701998

Structure Descriptors

InChI

1S/C15H25NO4/c1-15(16-2)13(19-15)11-9-7-5-3-4-6-8-10-12-14(17)20-18/h13,18H,3-12H2,1H3

InChIKey

NYURBVOZXRWAPK-UHFFFAOYSA-N

Smiles

O1[C@@H]([C@@]1(C)[N+]#[C-])CCCCCCCCCCC(=O)OO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Journal of Antibiotics. Vol. 41, Pg. 454, 1988.