Pantothenate

CAS Registry Number®

20938-62-9

CAS Name

Pantothenate

Molecular Formula

C9H16NO5

Cite this Page

Pantothenate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20938-62-9 (retrieved 2025-01-20) (CAS RN: 20938-62-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/p-1/t7-/m0/s1

InChIKey

InChIKey=GHOKWGTUZJEAQD-ZETCQYMHSA-M

SMILES

[C@@H](C(CO)(C)C)(C(NCCC([O-])=O)=O)O

Canonical SMILES

O=C([O-])CCNC(=O)C(O)C(C)(C)CO

Other Names for this Substance

  • β-Alanine, N-[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]-, ion(1-)
  • Pantothenic acid, ion(1-), D-
  • β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, ion(1-), (R)-
  • Pantothenate

Deleted or Replaced CAS Registry Numbers

312-09-4