Tabtoxin

CAS Registry Number®

40957-90-2

CAS Name

Tabtoxin

Molecular Formula

C11H19N3O6

Molecular Mass

289.29

Cite this Page

Tabtoxin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40957-90-2 (retrieved 2024-12-22) (CAS RN: 40957-90-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H19N3O6/c1-5(15)7(9(17)18)14-8(16)6(12)2-3-11(20)4-13-10(11)19/h5-7,15,20H,2-4,12H2,1H3,(H,13,19)(H,14,16)(H,17,18)/t5-,6+,7+,11+/m1/s1

InChIKey

InChIKey=BFSBNVPBVGFFCF-WDOVLDDZSA-N

SMILES

C(C[C@@H](C(N[C@@H]([C@@H](C)O)C(O)=O)=O)N)[C@@]1(O)C(=O)NC1

Canonical SMILES

O=C(O)C(NC(=O)C(N)CCC1(O)C(=O)NC1)C(O)C

Other Names for this Substance

  • L-Threonine, N-[(2S)-2-amino-4-[(3S)-3-hydroxy-2-oxo-3-azetidinyl]-1-oxobutyl]-
  • L-Threonine, γ-(3-hydroxy-2-oxo-3-azetidinyl)-L-α-aminobutyryl-, (S)-
  • N-[(2S)-2-Amino-4-[(3S)-3-hydroxy-2-oxo-3-azetidinyl]-1-oxobutyl]-L-threonine
  • Tabtoxin

CAS INSIGHTSTM
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