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Structure

L-Histidine mono(3-methyl-2-oxobutyrate)

CAS
78000-39-2
Catalog Number
ACM78000392
Category
Other Products
Molecular Weight
271.269780 [g/mol]
Molecular Formula
C6H9N3O2.C5H8O3

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Specification

Synonyms
SureCN11255331, EINECS 278-815-8, L-Histidine mono(3-methyl-2-oxobutyrate), 78000-39-2
IUPAC Name
(2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid;3-methyl-2-oxobutanoic acid
Canonical SMILES
CC(C)C(=O)C(=O)O.C1=C(NC=N1)CC(C(=O)O)N
InChI Key
TWBDHGZHCGZKOQ-JEDNCBNOSA-N
EC Number
278-815-8
Exact Mass
271.11700
H-Bond Acceptor
7
H-Bond Donor
4
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