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Gal beta(1-3)[neu5ac alpha(2-6)]glcnac-beta-pnp

CAS
754954-71-7
Catalog Number
ACM754954717
Category
Other Products
Molecular Weight
795.7
Molecular Formula
C31H45N3O21

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Specification

Synonyms
G0347, Gal beta(1-3)[Neu5Ac alpha(2-6)]GlcNAc-beta-pNP, 754954-71-7
IUPAC Name
(2R,4R,5R,6R)-5-acetamido-2-[[(2S,3S,4R,5S,6S)-5-acetamido-3-hydroxy-6-(4-nitrophenoxy)-4-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Canonical SMILES
CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OCC2C(C(C(C(O2)OC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C)OC4C(C(C(C(O4)CO)O)O)O)O)O
InChI Key
OQZSJFGKSKBLDR-VBVYDDFXSA-N
Boiling Point
1232.604ºC at 760 mmHg
Flash Point
699.254ºC
Density
1.68g/cm³
Exact Mass
795.25500
H-Bond Acceptor
21
H-Bond Donor
12
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