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Pantethine

Catalog Number
ACM16816674-1
CAS
16816-67-4
Structure
IUPAC Name
(2R)-N-[3-[2-[2-[3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]-2,4-dihydroxy-3,3-dimethylbutanamide
Molecular Weight
554.72
Molecular Formula
C22H42N4O8S2
Canonical SMILES
CC(C)(CO)[C@H](C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@@H](C(C)(C)CO)O)O
InChI
DJWYOLJPSHDSAL-ROUUACIJSA-N
InChI Key
InChI=1S/C22H42N4O8S2/c1-21(2,13-27)17(31)19(33)25-7-5-15(29)23-9-11-35-36-12-10-24-16(30)6-8-26-20(34)18(32)22(3,4)14-28/h17-18,27-28,31-32H,5-14H2,1-4H3,(H,23,29)(H,24,30)(H,25,33)(H,26,34)/t17-,18-/m0/s1
Flash Point
550.8°C
Density
1.19g/ml
Appearance
Colorless to pale yellow, clear, viscous liquid
Actives
95%
Physical State
Liquid
Typical Applications
Use as dispersing agent, emulsifying agent.
Use as pharmaceutical ingredient (For reference only).
Spec Sheet
Custom Q&A

What is the IUPAC name of Pantethine?

(2R)-N-[3-[2-[2-[3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]-2,4-dihydroxy-3,3-dimethylbutanamide.

What is the molecular weight of Pantethine?

554.72.

What is the molecular formula of Pantethine?

C22H42N4O8S2.

What is the SMILES notation for Pantethine?

CC(C)(CO)[C@H](C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@@H](C(C)(C)CO)O)O.

What is the InChI key for Pantethine?

InChI=1S/C22H42N4O8S2/c1-21(2,13-27)17(31)19(33)25-7-5-15(29)23-9-11-35-36-12-10-24-16(30)6-8-26-20(34)18(32)22(3,4)14-28/h17-18,27-28,31-32H,5-14H2,1-4H3,(H,23,29)(H,24,30)(H,25,33)(H,26,34)/t17-,18-/m0/s1.

What is the flash point of Pantethine?

550.8°C.

What is the density of Pantethine?

1.19g/ml.

What is the typical appearance of Pantethine?

Colorless to pale yellow, clear, viscous liquid.

What percentage of Pantethine is considered active?

95%.

What are some typical applications of Pantethine?

Use as dispersing agent and emulsifying agent. It can also be used as a pharmaceutical ingredient.

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