alpha-Maltotriose

HCID 192826CAS 6401-81-6

Basic information

Standard SMILES
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
InChIKey
FYGDTMLNYKFZSV-PXXRMHSHSA-N
Molecular formula
C18H32O16
Average molar mass
504.4 g/mol
Monoisotopic mass
504.16903494

Overview

Alpha-maltotriose is a maltotriose trisaccharide in which the glucose residue at the reducing end is in the pyranose ring form and has alpha configuration at the anomeric carbon atom.. It has a role as a human metabolite.

Names & identifiers

Preferred name
alpha-Maltotriose
IUPAC
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Names & synonyms

alpha-maltotriose6401-81-6CHEBI:27931DTXSID90858850alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranoseRefChem:936753GlyTouCan:G96370VADTXCID9028889G96370VAAmylose from potatoMFCD00134652alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp
Show more names
Porcelite3mbp2gh94ua8SCHEMBL35350133137-05-0Beta-D-Glc, O-beta-D-Glcalpha-D-Glc, O-alpha-D-glc

Database identifiers

CAS
6401-81-6
PubChem CID
192826
DTXSID
DTXSID90858850
ChEBI
CHEBI:27931
Nikkaji
J554.021F

Properties

Computed structural properties

XLogP
-6.9
Topological polar surface area
269 Ų
Hydrogen bond donors
11
Hydrogen bond acceptors
16
Rotatable bonds
7
Heavy atoms
34

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15
Collision Cross Section216.3 Ų [M+H]+ [CCS Type: DT; Method: stepped-field]

Related reactions

14 records

Linked notes

Loading…