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[5-methyl-2-oxo-3-(2-oxopropyl)-6-(1-phenylmethoxypropan-2-yl)oxan-4-yl] 3,5-dinitrobenzoate

[5-methyl-2-oxo-3-(2-oxopropyl)-6-(1-phenylmethoxypropan-2-yl)oxan-4-yl] 3,5-dinitrobenzoate structure

CAS No:
138847-00-4
Formula:
C26H28N2O10
Chemical Name:
[5-methyl-2-oxo-3-(2-oxopropyl)-6-(1-phenylmethoxypropan-2-yl)oxan-4-yl] 3,5-dinitrobenzoate
Synonyms:
2,4,6-trideoxy-4,6-dimethyl-2-(2-oxopropyl)-7-O-(phenylmethyl)-glycero-manno-heptono-1,5-lactone 3-(3,5-dinitrobenzoate);DOPPM-valerolactone diNO2Ph;Doppm-valerolactone dino2Ph;138847-00-4;2,4,6-Trideoxy-4,6-dimethyl-2-(2-oxopropyl)-7-O-(phenylmethyl)-glycero-manno-heptono-1,5-lactone 3-(3,5-dinitrobenzoate)

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[5-methyl-2-oxo-3-(2-oxopropyl)-6-(1-phenylmethoxypropan-2-yl)oxan-4-yl] 3,5-dinitrobenzoate Basic Attributes

Molecular Weight：

528.5 g/mol

Exact Mass：

528.17439509 g/mol

Characteristics

PSA：

171 Å²

Drug Information

MeSH Entry Terms：

2,4,6-trideoxy-4,6-dimethyl-2-(2-oxopropyl)-7-O-(phenylmethyl)-glycero-manno-heptono-1,5-lactone 3-(3,5-dinitrobenzoate)

Computed Properties

Molecular Weight:528.5
XLogP3:3.8
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:528.17439509
Monoisotopic Mass:528.17439509
Topological Polar Surface Area:171
Heavy Atom Count:38
Complexity:856
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [5-methyl-2-oxo-3-(2-oxopropyl)-6-(1-phenylmethoxypropan-2-yl)oxan-4-yl] 3,5-dinitrobenzoate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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