Metabolomics Structure Database

 
MW REGNO: 51517
Common Name:alpha-maltotriose
Systematic Name:alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose
Synonyms:alpha-D-Glcp-(1->4)-alpha-D-Glcp-(1->4)-alpha-D-Glcp; alpha-maltotriose [PubChem Synonyms]
Exact Mass:
504.1690 (neutral)    Calculate m/z:
Formula:C18H32O16
InChIKey:FYGDTMLNYKFZSV-PXXRMHSHSA-N
ClassyFire superclass:Organic oxygen compounds
ClassyFire class:Organooxygen compounds
ClassyFire subclass:Carbohydrates and carbohydrate conjugates
ClassyFire direct parent:Oligosaccharides
SMILES:C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]1[C@@H](CO)O[C@@H]([C@@H]([C@H]1O)O)O[C@@H]1[C@@H](CO)O[C@@H]([C@@H]([C@H]1O)O)O)O)O)O)O
Studies:-

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External database links:

PubChem CID:192826
CHEBI ID:27931

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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