Summary

IMPPAT Phytochemical identifier: IMPHY011727

Phytochemical name: Sorbitol

Synonymous chemical names:
-d-glucitol, d-sorbitol, glucitol, sorbitol

External chemical identifiers:
CID:5780, ChEMBL:CHEMBL1682, ChEBI:17924, ZINC:ZINC000018279893, FDASRS:506T60A25R, SureChEMBL:SCHEMBL763, MolPort-003-928-393

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Chemical structure information

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

InChI:
InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1

InChIKey:
FBPFZTCFMRRESA-JGWLITMVSA-N

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

NP Classifier Superclass: Saccharides

NP Classifier Class: Monosaccharides

NP-Likeness score: 1.143

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Chemical structure download