CALCIUM PANTOTHENATE-13C6, 15N2 (DI-BETA-ALANINE-13C6, 15N2) ,137-08-6

CALCIUM PANTOTHENATE-13C6, 15N2 (DI-BETA-ALANINE-13C6, 15N2)

Basic Information
Product Name：	CALCIUM PANTOTHENATE-13C6, 15N2 (DI-BETA-ALANINE-13C6, 15N2)
CAS：	137-08-6
English Synonyms：	CALCIUM PANTOTHENATE-13C6, 15N2 (DI-BETA-ALANINE-13C6, 15N2) ; VITAMIN B5 (DI-BETA-ALANINE-13C6,15N2) CALCIUM SALT ; D-CALCIUM PANTHOTENATE ; VITAMIN B5-[13C6,15N2] ; CALCIUM PANTOTHENATE-[13C6,15N2]
MDL Number.：	MFCD11656126
H bond acceptor：	12
H bond donor：	6
Smile：	CC(C)(CO)[C@H](C(=O)[15NH][13CH2][13CH2][13C](=O)O[Ca]O[13C](=O)[13CH2][13CH2][15NH]C(=O)[C@@H](C(C)(C)CO)O)O
InChi：	InChI=1S/2C9H17NO5.Ca/c21-9(2,5-11)7(14)8(15)10-4-3-6(12)13;/h27,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);/q;;+2/p-2/t27-;/m00./s1/i23+1,4+1,6+1,10+1;
InChiKey：	InChIKey=FAPWYRCQGJNNSJ-DXAJRXMUSA-L
Property
Comments：	ASSAY METHOD: CP MASS SHIFT: M+8 STORAGE TEMPERATURE: -20 DEG C WGK: 1
Information：	ISOTOPIC PURITY: 98 ATOM% 15N ISOTOPIC PURITY: 99 ATOM% 13C MW: 484.40 BY ATOM% CALCULATION
Safety information
WGK Germany：	1

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