Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID002354

Phytochemical name: alpha-D-Xylofuranoside, methyl 2,3-di-O-methyl-

Synonymous chemical names:
methyl-2-o-methyl-α-d-xylofuranoside

External chemical identifiers:
CID:CID_12775311

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Chemical structure information

SMILES:
OC[C@H]1O[C@@H]([C@@H]([C@H]1OC)OC)OC

InChI:
InChI=1S/C8H16O5/c1-10-6-5(4-9)13-8(12-3)7(6)11-2/h5-9H,4H2,1-3H3/t5-,6+,7-,8+/m1/s1

InChIKey:
FYKMACNFDGQAMI-CWKFCGSDSA-N

DeepSMILES:
OC[C@H]O[C@@H][C@@H][C@H]5OC)))OC)))OC

Functional groups:
CO, CO[C@H](C)OC, COC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCOC1

Scaffold Graph/Node level:
C1CCOC1

Scaffold Graph level:
C1CCCC1

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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-Likeness score: 2.103

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Chemical structure download