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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 22:23:03 UTC
Update Date2022-03-07 02:55:12 UTC
HMDB IDHMDB0037138
Secondary Accession Numbers
  • HMDB37138
Metabolite Identification
Common NameMaltodextrin
DescriptionMaltodextrin, also known as alpha-malt sugar or glca1-4glca, belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Maltodextrin is an odorless tasting compound. Maltodextrin is found, on average, in the highest concentration within a few different foods, such as fruit gum, marshmallow, and beer and in a lower concentration in toffee, rye bread, and other bread. Maltodextrin has also been detected, but not quantified in, several different foods, such as winged beans (Psophocarpus tetragonolobus), sacred lotus (Nelumbo nucifera), green bell peppers (Capsicum annuum), ginkgo nuts (Ginkgo biloba), and gadus (common cod). This could make maltodextrin a potential biomarker for the consumption of these foods. Maltodextrin is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Maltodextrin.
Structure
Data?1563862983
Synonyms
ValueSource
4-O-alpha-D-Glucopyranosyl-alpha-D-glucopyranoseChEBI
alpha-D-GLCP-(1->4)-alpha-D-GLCPChEBI
alpha-Malt sugarChEBI
Glca1-4glcaChEBI
Glcalpha1-4glcaChEBI
Glcalpha1-4glcalphaChEBI
MALTOSEChEBI
4-O-a-D-Glucopyranosyl-a-D-glucopyranoseGenerator
4-O-Α-D-glucopyranosyl-α-D-glucopyranoseGenerator
a-D-GLCP-(1->4)-a-D-GLCPGenerator
Α-D-GLCP-(1->4)-α-D-GLCPGenerator
a-Malt sugarGenerator
Α-malt sugarGenerator
a-MaltoseGenerator, HMDB
α-maltoseGenerator, HMDB
Linear maltodextrinHMDB
Maltodextrin(N)HMDB
Maltodextrin(N-2)HMDB
Chemical Formula(C12H22O11)n
Average Molecular WeightNot Available
Monoisotopic Molecular WeightNot Available
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry Number9050-36-6
SMILES
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
InChI Identifier
InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11+,12-/m1/s1
InChI KeyGUBGYTABKSRVRQ-ASMJPISFSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct ParentO-glycosyl compounds
Alternative Parents
Substituents
  • O-glycosyl compound
  • Disaccharide
  • Oxane
  • Secondary alcohol
  • Hemiacetal
  • Oxacycle
  • Organoheterocyclic compound
  • Polyol
  • Acetal
  • Hydrocarbon derivative
  • Primary alcohol
  • Alcohol
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External Descriptors
Ontology
Physiological effect
Disposition
Route of exposureSource
ProcessNot Available
Role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point240 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP-3ALOGPS
logS0.23ALOGPS
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+174.18430932474
DeepCCS[M-H]-172.0530932474
DeepCCS[M-2H]-205.45230932474
DeepCCS[M+Na]+179.95430932474
AllCCS[M+H]+178.132859911
AllCCS[M+H-H2O]+175.232859911
AllCCS[M+NH4]+180.932859911
AllCCS[M+Na]+181.732859911
AllCCS[M-H]-174.432859911
AllCCS[M+Na-2H]-173.932859911
AllCCS[M+HCOO]-173.632859911

Predicted Kovats Retention Indices

Not Available
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Maltodextrin GC-MS (Non-derivatized) - 70eV, Positivesplash10-03e9-4897000000-332d470623cd7f1e1ced2017-11-06Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 10V, Positive-QTOFsplash10-01tc-0419000000-7756e1f28bcc76e75af12016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 20V, Positive-QTOFsplash10-03fr-1915000000-f7a01cbe1a1eba1f39b12016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 40V, Positive-QTOFsplash10-01we-4920000000-0dcd848ee51f4218f67a2016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 10V, Negative-QTOFsplash10-0006-2379000000-abb41b2f1a43083992ca2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 20V, Negative-QTOFsplash10-0200-3923000000-87a71f93194716a7f75d2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 40V, Negative-QTOFsplash10-004l-6900000000-a0954b0f7ffc379d1dee2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 10V, Positive-QTOFsplash10-0006-0109000000-9d0f9a68a67bafd734ab2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 20V, Positive-QTOFsplash10-01rw-3898000000-7f495a1bcfdbed6466c42021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 40V, Positive-QTOFsplash10-01ti-9210000000-b8a83657f0266d372bee2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 10V, Negative-QTOFsplash10-000x-1069000000-9cd867711bca0eecf9352021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 20V, Negative-QTOFsplash10-0006-9365000000-65403961bfb5e35eaa0d2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Maltodextrin 40V, Negative-QTOFsplash10-000l-9200000000-0de9785c1c5df1430dd22021-09-24Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB016133
KNApSAcK IDNot Available
Chemspider ID388469
KEGG Compound IDC00897
BioCyc IDALPHA-MALTOSE
BiGG IDNot Available
Wikipedia LinkMaltose
METLIN IDNot Available
PubChem Compound439341
PDB IDNot Available
ChEBI ID18167
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .