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Substance Name: Xanthoascin
RN: 61391-08-0
UNII: J2251719T3
InChIKey: ONZXHWTZPHRYLC-SIBCGJTDSA-N

Note

  • From Aspergillus candidus.

Classification Code

  • Natural Product

Molecular Formula

  • C23-H20-N2-O2

Molecular Weight

  • 356.423
 
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Names and Synonyms

Name of Substance

  • Xanthoascin

Synonyms

  • UNII-J2251719T3
  • Xanthoascin

Systematic Name

  • Phenol, 4-(4-(3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-6-yl)-2,3-diisocyano-1,3-butadienyl)-

Registry Numbers

CAS Registry Number

  • 61391-08-0

FDA UNII

  • J2251719T3

System Generated Number

  • 0061391080

Structure Descriptors

InChI

1S/C23H20N2O2/c1-23(2)12-11-18-13-17(7-10-22(18)27-23)15-21(25-4)20(24-3)14-16-5-8-19(26)9-6-16/h5-10,13-15,26H,11-12H2,1-2H3/b20-14-,21-15-

InChIKey

ONZXHWTZPHRYLC-SIBCGJTDSA-N

Smiles

c1(ccc(cc1)\C=C(\C(=C\c1ccc2c(CCC(O2)(C)C)c1)[N+]#[C-])[N+]#[C-])O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - domestic LDLo subcutaneous 2mg/kg (2mg/kg) LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), ZONAL"

LIVER: FATTY LIVER DEGERATION
Japanese Journal of Experimental Medicine. Vol. 48, Pg. 187, 1978.
mouse LD50 subcutaneous 20mg/kg (20mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 6, Pg. 280, 1981.