[1-13Cglc]lactose monohydrate

Catalog Number	ACM287100623-1
CAS	287100-62-3
Structure
Synonyms	[1-13C]lactose monohydrate; 4-O-beta-D-galactopyranosyl-D-[1-13C]glucose; Lactose-13C (glucose-1-13C) monohydrate
IUPAC Name	(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)(6-13C)oxan-3-yl]oxyoxane-3,4,5-triol;hydrate
Molecular Weight	361.31
Molecular Formula	13CC11H24O12
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/i11+1;
InChI Key	WSVLPVUVIUVCRA-FKZVOWNZSA-N
Melting Point	219 °C (dec.) (lit.)
Isomeric SMILES	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[13CH]([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O
Isotopic Enrichment	99 atom % 13C
Unlabeled CAS	64044-51-5

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[1-13Cglc]lactose monohydrate (287100-62-3)

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