Summary

IMPPAT Phytochemical identifier: IMPHY005695

Phytochemical name: 2,3,4-Tri-o-methyl-d-xylose

Synonymous chemical names:
2,3,4-tri-o-methyl-d-xylose, 2,3,4-tri-o-methylxylose

External chemical identifiers:
CID:22215468, ZINC:ZINC000138486887, FDASRS:95AWB55YGJ, SureChEMBL:SCHEMBL7156219

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Chemical structure information

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

InChI:
InChI=1S/C8H16O5/c1-11-6(4-9)8(13-3)7(5-10)12-2/h4,6-8,10H,5H2,1-3H3/t6-,7+,8+/m0/s1

InChIKey:
TZGIHUVVJVQDHY-XLPZGREQSA-N

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

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-Likeness score: 1.737

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Chemical structure download