Neotame

CAS Registry Number®

165450-17-9

CAS Name

Neotame

Molecular Formula

C20H30N2O5

Molecular Mass

378.46

Cite this Page

Neotame.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=165450-17-9 (retrieved 2024-11-21) (CAS RN: 165450-17-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

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-/m0/s1

InChIKey

InChIKey=HLIAVLHNDJUHFG-HOTGVXAUSA-N

SMILES

[C@@H](CC1=CC=CC=C1)(NC([C@@H](NCCC(C)(C)C)CC(O)=O)=O)C(OC)=O

Canonical SMILES

O=C(O)CC(NCCC(C)(C)C)C(=O)NC(C(=O)OC)CC=1C=CC=CC1

Other Names for this Substance

  • L-Phenylalanine, N-(3,3-dimethylbutyl)-L-α-aspartyl-, 2-methyl ester
  • L-Phenylalanine, N-[N-(3,3-dimethylbutyl)-L-α-aspartyl]-, 1-methyl ester
  • Neotame
  • Mirasee
  • E 961

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration