CAS 356786-94-2 Pantothenic Acid-13C3,15N Hemicalcium Salt - Analytical Products / Alfa Chemistry

CAT	APS356786942
CAS	356786-94-2
Structure
Synonyms	Pantothenic acid-13C3,15N hemicalcium salt,β-Alanine-1,2,3-13C3-15N, N-[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]-, calcium salt (2:1), Vitamin B5 (β-alanine-13C3,15N) calcium salt, Calcium Pantothenate-[13C6,15N2], β-Alanine-13C3-15N, N-[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]-, calcium salt (2:1) (9CI), Vitamin B5-[13C6,15N2], D-Pantothenic acid-13C3,15N hemicalcium salt (β-alanine-13C3,15N)
IUPAC Name	calcium;3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino](1,2,3-^{13}C_{3})propanoate
Molecular Weight	484.47
Molecular Formula	213C3C6H1615NO5.Ca
Canonical SMILES	[Ca+2].CC(C)(CO)[C@@H](O)C(=O)[15NH][13CH2][13CH2][13C](=O)[O-].CC(C)(CO)[C@@H](O)C(=O)[15NH][13CH2][13CH2][13C](=O)[O-]
InChI	InChI=1S/C9H17NO5.Ca/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);/q;+2/p-1/t7-;/m1./s1

Accurate Mass	484.1825
Format	Neat
Product Type	Stable Isotope Labelled
Shipping	Room Temperature
Size	1MG
Storage Conditions	-20°C Freezer
Subcategory	Pharmaceutical, Chiral molecules, Stable isotope labelled compounds

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