Alpha-lactose monohydrate (CHEBI:189432)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Alpha-lactose monohydrate

ChEBI ID	CHEBI:189432

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

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Formula

C12H22O11.H2O

Net Charge

Average Mass

360.312

Monoisotopic Mass

360.12678

InChI

InChI=1S/C12H22O11.H2O/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17;/h3-20H,1-2H2;1H2/t3-,4-,5+,6+,7-,8-,9-,10-,11+,12+;/m1./s1

InChIKey

WSVLPVUVIUVCRA-KPKNDVKVSA-N

SMILES

O([C@H]1[C@H](O)[C@@H](O)[C@H](O[C@@H]1CO)O)[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO.O

Metabolite of Species	Details
Arabidopsis thaliana (NCBI:txid3702)	Found in guard cell (BTO:0000544). See: MetaboLights Study

ChEBI Ontology
Outgoing	Alpha-lactose monohydrate (CHEBI:189432) is a glycoside (CHEBI:24400)

IUPAC Name

(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol;hydrate

Registry Number	Type	Source
5989-81-1	CAS Registry Number	ChemIDplus