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ChemicalBook--->CAS DataBase List--->496-65-1

496-65-1

496-65-1 Structure

496-65-1 Structure
IdentificationBack Directory
[Name]

(R)-2,4-dihydroxy-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutyramide
[CAS]

496-65-1
[Synonyms]

LBF
Pantetheine
(R)-Pantetheine
(D)-(+)-Pantetheine
Lactobacillusbulgaricusfactor
N-(Pantothenyl)-β-aminoethanethiol
pantethine, Bis(N-pantothenylamidoethyl) disulfide
2,4-dihydroxy-3,3-dimethyl-N-[2-(2-sulfanylethylcarbamoyl)ethyl]butanamide
(R)-2,4-Dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3-dimethylbutyramide
(2R)-2,4-Dihydroxy-N-[2-[(2-mercaptoethyl)carbamoyl]ethyl]-3,3-dimethylbutyramide
(R)-2,4-Dihydroxy-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutanamide
(R)-2,4-dihydroxy-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutyramide
(2R)-2,4-Dihydroxy-N-[3-[(2-mercaptoethyl)amino]-3-oxopropyl]-3,3-dimethylbutanamide
[EINECS(EC#)]

207-824-1
[Molecular Formula]

C11H22N2O4S
[MDL Number]

MFCD00056757
[MOL File]

496-65-1.mol
[Molecular Weight]

278.368
Chemical PropertiesBack Directory
[Appearance]

slight yellow to colorless liquid
[alpha ]

D20 +12.9° (c = 4.5 in water)
[Boiling point ]

635.0±55.0 °C(Predicted)
[density ]

1.202±0.06 g/cm3(Predicted)
[storage temp. ]

?20°C
[solubility ]

Methanol (Slightly), Water (Slightly)
[form ]

Oil
[pka]

9.75±0.10(Predicted)
[color ]

Pale Yellow to Light Yellow
[optical activity]

[α]/D 17±2°, c = 1 in H2O
[BRN ]

1714196
Hazard InformationBack Directory
[Chemical Properties]

slight yellow to colorless liquid
[Definition]

ChEBI: An amide obtained by formal condensation of the carboxy group of pantothenic acid and the maino group of cysteamine.
[Uses]

Pantetheine-d4 is a deuterated version of Pantetheine, a building block of Coenzyme A.
[Biochem/physiol Actions]

Metabolite in carbapenem biosynthesis, pantothenate and CoA biosynthesis and biosynthesis of secondary metabolites.
[IC 50]

Human Endogenous Metabolite
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

25
[Safety Statements ]

45
[RIDADR ]

UN 2811 6.1 / PGIII
[WGK Germany ]

3
[Toxicity]

LD50 intraperitoneal in mouse: 440mg/kg
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