Maltulose

HCID 87177

Basic information

CAS
17606-72-3
Standard SMILES
O=C(CO)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO
InChIKey
PFCRQPBOOFTZGQ-RGXJTGTOSA-N
Molecular formula
C12H22O11
Average molar mass
342.3 g/mol
Monoisotopic mass
342.11621151

Names & identifiers

Preferred name
Maltulose
IUPAC
(3S,4R,5R)-1,3,5,6-tetrahydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-one

Names & synonyms

Maltulose17606-72-34-O-alpha-D-Glucopyranosyl-D-fructoseQ7GN4HW47SD-Fructose, 4-O-alpha-D-glucopyranosyl-UNII-Q7GN4HW47SEINECS 241-578-6D-FRUCTOSE, 4-O-.ALPHA.-D-GLUCOPYRANOSYL-FRUCTOSE, 4-O-.ALPHA.-D-GLUCOPYRANOSYL-, D-RefChem:155496FRUCTOSE, 4-O-ALPHA-D-GLUCOPYRANOSYL-, D-4-O-alpha-D-glucopyranosyl-beta-D-fructofuranose
Show more names
4-O-alpha-D-Glucopyranosyl-D-fructofuranosealpha-D-Glcp-(1->4)-beta-D-Frufalpha-D-glucopyranosyl-(1->4)-beta-D-fructofuranoseCHEBI:79286(3S,4R,5R)-1,3,5,6-Tetrahydroxy-4-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexan-2-oneMFCD00191667(3S,4R,5R)-1,3,5,6-tetrahydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexan-2-oned-fructose, 4-o-|A-d-glucopyranosyl-

Database identifiers

CAS
17606-72-3
PubChem CID
87177
DTXSID
DTXSID00938753
UNII
Q7GN4HW47S
EC Number
241-578-6
Nikkaji
J287.086J

Properties

Computed structural properties

XLogP
-4.8
Topological polar surface area
197 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
11
Rotatable bonds
8
Heavy atoms
23

Experimental & physicochemical properties

Collision Cross Section180.1 Ų [M+Na]+;180 Ų [M-H]-

Related reactions

2 records

Compound notes

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