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Neotame-[d3]

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General Information
Catalog: BLP-014818
Molecular Formula: C20H27D3N2O5
Molecular Weight: 381.48

Chemical Structure

Description	Neotame-[d3] is a labelled analogue of Neotame, which is a non-caloric artificial sweetener and aspartame analog by NutraSweet. By mass, it is 8000 times sweeter than sucrose.
Synonyms	N-(3,3-Dimethylbutyl)-L-α-aspartyl-L-phenylalanine 2-(Methyl-d3) Ester; Neotame-d3; d3-Neotame
IUPAC Name	(3R)-3-(3,3-dimethylbutylamino)-4-oxo-4-[[(2S)-1-oxo-3-phenyl-1-(trideuteriomethoxy)propan-2-yl]amino]butanoic acid
Related CAS	165450-17-9 (unlabelled)
Canonical SMILES	CC(C)(C)CCNC(CC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)OC
InChI	InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16+/m1/s1/i4D3
InChI Key	HLIAVLHNDJUHFG-RYPTXDJRSA-N
Melting Point	>63 °C
Purity	94.87%; 99.9% atom D
Solubility	DMSO (Slightly) ,Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	-20°C ,Hygroscopic