Summary

IMPPAT Phytochemical identifier: IMPHY010263

Phytochemical name: 1-Deoxy-d-glucitol

Synonymous chemical names:
1-deoxy-d-glucitol

External chemical identifiers:
CID:10678630, ZINC:ZINC000003872642, SureChEMBL:SCHEMBL218934

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Chemical structure information

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

InChI:
InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3/t3-,4+,5+,6+/m0/s1

InChIKey:
SKCKOFZKJLZSFA-SLPGGIOYSA-N

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

Functional groups:
CO

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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: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.812

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Chemical structure download