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Substance Name: Neotame [NF]
RN: 165450-17-9
UNII: VJ597D52EX
InChIKey: HLIAVLHNDJUHFG-HOTGVXAUSA-N

Molecular Formula

  • C20-H30-N2-O5

Molecular Weight

  • 378.466
 
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Names and Synonyms

Name of Substance

  • Neotame
  • Neotame [NF]

Synonyms

  • HSDB 7965
  • N-(N-(3,3-dimethylbutyl)-L-alpha-aspartyl)-L-phenylalanine 1-methyl ester
  • NC 00723
  • Neotame
  • UNII-VJ597D52EX

Systematic Name

  • L-Phenylalanine, N-(3,3-dimethylbutyl)-L-alpha-aspartyl-, 2-methyl ester

Superlist Name

  • Neotame

Registry Numbers

CAS Registry Number

  • 165450-17-9

FDA UNII

  • VJ597D52EX

System Generated Number

  • 0165450179

Structure Descriptors

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-/m0/s1

InChIKey

HLIAVLHNDJUHFG-HOTGVXAUSA-N

Smiles

C(=O)(OC)[C@@H](NC(=O)[C@H](CC(=O)O)NCCC(C)(C)C)Cc1ccccc1