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alpha-D-Glucopyranose, 4-O-alpha-D-glucopyranosyl-, 1-(dihydrogen phosphate)

HCID 167489
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
15896-49-8
Standard SMILES
O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
InChIKey
VRKQBSISJQUWFI-QUYVBRFLSA-N
Molecular formula
C12H23O14P
Average molar mass
422.28 g/mol
Monoisotopic mass
422.0825424

Overview

Maltose 1-phosphate is a maltose phosphate having the phosphate group located at the 1-position. It is a conjugate acid of a maltose 1-phosphate(2-).

Names & identifiers

Preferred name
alpha-D-Glucopyranose, 4-O-alpha-D-glucopyranosyl-, 1-(dihydrogen phosphate)
IUPAC
[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl] dihydrogen phosphate
English name
maltose 1-phosphate
Molecular formula
C12H23O14P
Molecular weight
422.28

Names & synonyms

Maltose 1-phosphateMalt1PMaltose-1-phosphateMaltose, 1-(dihydrogen phosphate)15896-49-8CHEBI:63592[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl] dihydrogen phosphatealpha-D-Glucopyranose, 4-O-alpha-D-glucopyranosyl-, 1-(dihydrogen phosphate)((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyoxan-2-yl) dihydrogen phosphateRefChem:155482alpha-maltose 1-phosphateSCHEMBL28185393
Show more names
α-D-Glucopyranose, 4-O-α-D-glucopyranosyl-, 1-(dihydrogen phosphate)
DTXSID709360244-O-Hexopyranosyl-1-O-phosphonohexopyranoseC20237Q271326974-O-alpha-D-glucopyranosyl-1-O-phosphono-alpha-D-glucopyranose

Properties

Computed structural properties

XLogP
-5.8
Topological polar surface area
236 Ų
Hydrogen bond donors
9
Hydrogen bond acceptors
14
Rotatable bonds
6
Heavy atoms
27
Formal charge
0
Complexity
528

Physicochemical properties

Boiling point
811.7 · 811.7±75.0 °C(Predicted)
Density
1.89 · 1.89±0.1 g/cm3(Predicted)
pka
1.73 · 1.73±0.10(Predicted)

Chemistry & industry

Additional notes

DefinitionChEBI: A maltose phosphate having the phosphate group located at the 1-position.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
15896-49-8
PubChem CID
167489
DTXSID
DTXSID70936024
ChEBI
CHEBI:63592
Nikkaji
J747.823B