 Home > Encyclopedia > (2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol structure

CAS No:
66347-27-1
Formula:
C18H25NO12
Chemical Name:
(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Synonyms:
4-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;NPAFPBG;para-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;66347-27-1;Npafpbg;4-Nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;4-Nitrophenyl 2-O-(a-L-fucopyranosyl)-b-D-galactopyranoside;(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol;4-Nitrophenyl 2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;C18H25NO12;DTXSID90216557;Para-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;ZINC77311677;W0350;W-203462;p-Nitrophenyl 2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside;beta-D-Galactopyranoside, 4-nitrophenyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-;(2S,3S,4R,5S,6S)-2-(((2S,3R,4S,5R,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol

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(2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol Basic Attributes

Molecular Weight：

447.4 g/mol

Exact Mass：

447.13767523 g/mol

DSSTox ID：

DTXSID90216557

Characteristics

PSA：

204 Å²

Drug Information

MeSH Entry Terms：

4-nitrophenyl-2-O-(alpha-L-fucopyranosyl)-beta-D-galactopyranoside

Computed Properties

Molecular Weight:447.4
XLogP3:-1.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:447.13767523
Monoisotopic Mass:447.13767523
Topological Polar Surface Area:204
Heavy Atom Count:31
Complexity:597
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S,3S,4R,5S,6S)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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