Summary

IMPPAT Phytochemical identifier: IMPHY002895

Phytochemical name: 2-o-Methylxylose

Synonymous chemical names:
2-o-methylxylose, d-2-o-methylxylose

External chemical identifiers:
CID:14536300, ChEBI:173727, ZINC:ZINC000004557143, FDASRS:K40894DQHT, SureChEMBL:SCHEMBL616881

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Chemical structure information

SMILES:
CO[C@H]([C@H]([C@@H](CO)O)O)C=O

InChI:
InChI=1S/C6H12O5/c1-11-5(3-8)6(10)4(9)2-7/h3-7,9-10H,2H2,1H3/t4-,5+,6+/m1/s1

InChIKey:
ALNDFFUAQIVVPG-SRQIZXRXSA-N

DeepSMILES:
CO[C@H][C@H][C@@H]CO))O))O))C=O

Functional groups:
CC=O, CO, COC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbohydrates and carbohydrate conjugates

NP Classifier Biosynthetic pathway: Carbohydrates

NP Classifier Superclass: Saccharides

NP Classifier Class: Monosaccharides

NP-Likeness score: 2.052

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Chemical structure download