Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000011

Phytochemical name: D-Galactose

Synonymous chemical names:
sugar galactose, d-galactose, d-galactopyranose, galactose

External chemical identifiers:
CID:CID_6036, ChEMBL:CHEMBL195923, ChEBI:CHEBI:4139, SureChEMBL:SCHEMBL38935, MolPort-003-934-464

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Chemical structure information

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

InChI:
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6?/m1/s1

InChIKey:
WQZGKKKJIJFFOK-SVZMEOIVSA-N

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

Functional groups:
CO, COC(O)C

Link to spectral information:
MSBNK-RIKEN_ReSpect-PS019807, MSBNK-RIKEN-PR010044, MSBNK-RIKEN-PR010045, MSBNK-MPI_for_Chemical_Ecology-CE000691, MSBNK-Osaka_Univ-OUF00236, MSBNK-Osaka_Univ-OUF00235

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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, Shikimates and Phenylpropanoids

NP Classifier Superclass: Saccharides, Flavonoids

NP Classifier Class: Disaccharides, Flavones, Monosaccharides, Polysaccharides

NP-Likeness score: 2.627

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Chemical structure download