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Structure

Heparin disaccharide i-a sodium

CAS
136098-00-5
Catalog Number
ACM136098005
Category
Other Products
Molecular Weight
605.39
Molecular Formula
C14H18NNa3O17S2

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Specification

Synonyms
Heparin disaccharide I-A sodium salt, 136098-00-5, CTK8E7042, |A-| currencyUA-2S-[1 inverted exclamation marku4]-GlcNAc-6S
IUPAC Name
trisodium;(2R,3R,4S)-2-[(2R,3S,4R,5R)-5-acetamido-4,6-dihydroxy-2-(sulfonatooxymethyl)oxan-3-yl]oxy-4-hydroxy-3-sulfonatooxy-3,4-dihydro-2H-pyran-6-carboxylate
Canonical SMILES
CC(=O)NC1C(C(C(OC1O)COS(=O)(=O)[O-])OC2C(C(C=C(O2)C(=O)[O-])O)OS(=O)(=O)[O-])O.[Na+].[Na+].[Na+]
InChI Key
WRWNGZNBPYOKPM-NYNVPWSXSA-K
Exact Mass
604.97100
H-Bond Acceptor
17
H-Bond Donor
4
Safety Description
S22
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