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Substance Name: Pantetheine
RN: 496-65-1
UNII: VCH6X4IARE
InChIKey: ZNXZGRMVNNHPCA-VIFPVBQESA-N

Note

  • An intermediate in the pathway of coenzyme A formation in mammalian liver and some microorganisms.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H22-N2-O4-S

Molecular Weight

  • 278.3708
 
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Names and Synonyms

Name of Substance

  • Pantetheine

MeSH Heading

  • Pantetheine

Synonyms

  • (R)-Pantetheine
  • D-Pantetheine
  • EINECS 207-824-1
  • Lactobacillus bulgaricus factor
  • LBF
  • Pantetheine
  • UNII-VCH6X4IARE

Systematic Names

  • (R)-2,4-Dihydroxy-N-(3-((2-mercaptoethyl)amino)-3-oxopropyl)-3,3-dimethylbutyramide
  • Butanamide, 2,4-dihydroxy-N-(3-((2-mercaptoethyl)amino)-3-oxopropyl)-3,3-dimethyl-, (R)-
  • Butyramide, 2,4-dihydroxy-N-(2-((2-mercaptoethyl)carbamoyl)ethyl)-3,3-dimethyl-

Registry Numbers

CAS Registry Number

  • 496-65-1

FDA UNII

  • VCH6X4IARE

Other Registry Numbers

  • 1971-08-0
  • 31363-00-5

System Generated Number

  • 0000496651

Structure Descriptors

InChI

1S/C11H22N2O4S/c1-11(2,7-14)9(16)10(17)13-4-3-8(15)12-5-6-18/h9,14,16,18H,3-7H2,1-2H3,(H,12,15)(H,13,17)/t9-/m0/s1

InChIKey

ZNXZGRMVNNHPCA-VIFPVBQESA-N

Smiles

C(=O)(C(C(CO)(C)C)O)NCCC(=O)NCCS

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 440mg/kg (440mg/kg)   Radiation Research. Vol. 7, Pg. 13, 1957.