Summary

IMPPAT Phytochemical identifier: IMPHY014916

Phytochemical name: D-Fructose

Synonymous chemical names:
fructose

External chemical identifiers:
CID:2723872, ChEMBL:CHEMBL2325229, ChEBI:37714, SureChEMBL:SCHEMBL239448

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Chemical structure information

SMILES:
OCC1(O)OC[C@H]([C@H]([C@@H]1O)O)O

InChI:
InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1

InChIKey:
LKDRXBCSQODPBY-VRPWFDPXSA-N

DeepSMILES:
OCCO)OC[C@H][C@H][C@@H]6O))O))O

Functional groups:
CO, COC(C)(C)O

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCOCC1

Scaffold Graph/Node level:
C1CCOCC1

Scaffold Graph level:
C1CCCCC1

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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: 2.328

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Chemical structure download