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Structure

Beta-D-gal-(1->3)-beta-D-glcnac-1->oc6h4no2-p

CAS
57467-13-7
Catalog Number
ACM57467137
Category
Other Products
Molecular Weight
504.44
Molecular Formula
C20H28N2O13

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Specification

Synonyms
PNP-Lac-N-bioside, PNP-Lacto-N-bioside, Gal1-b-3GlcNAc-b-PNP, SureCN7720017, 57467-13-7, FT-0672832, W0306, 4-Nitrophenyl 2-acetamido-2-deoxy-3-O-(-beta-D-galactopyranosyl)-beta-D-glucopyranoside, p-Nitrophenyl 2-Acetamido-2-deoxy-3-O-(|A-D-galactopyranosyl)-|A-D-glucopyranoside
IUPAC Name
N-[(2S,3R,4R,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
Canonical SMILES
CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)OC3C(C(C(C(O3)CO)O)O)O
InChI Key
INMOOBMAIAWVBW-KDKNCOTBSA-N
Boiling Point
879ºC at 760 mmHg
Melting Point
202-203ºC dec.
Flash Point
485.4ºC
Density
1.61g/cm³
Exact Mass
504.15900
H-Bond Acceptor
13
H-Bond Donor
7
Safety Description
22-24/25
WGK Germany
3
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