Common Name: (2S*,3S*)-5-amino-3-hydroxy-5-oxopentan-2-yl 3-(formylamino)-2-hydroxybenzoate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C13H16N2O6/c1-7(10(17)5-11(14)18)21-13(20)8-3-2-4-9(12(8)19)15-6-16/h2-4,6-7,10,17,19H,5H2,1H3,(H2,14,18)(H,15,16)/t7-,10-/m0/s1
InChIKey: InChIKey=DQLHQRRNOGCTFT-XVKPBYJWSA-N
Formula: C13H16N2O6
Molecular Weight: 296.276534
Exact Mass: 296.100836
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhao, P.J., Li, G.H., Shen, Y.M. Chem Biodiversity (2006) 3, 337-42
Species:
Notes: Family : Alkaloids, Type : Anilines; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Position | PPM |
---|---|
1 (C) | 112.6 |
2 (C) | 150.6 |
3 (C) | 127.5 |
4 (CH) | 124.8 |
5 (CH) | 119 |
6 (CH) | 120.1 |
7 (C) | 170.1 |
8 (CH) | 74.9 |
9 (CH) | 75.3 |
10 (CH2) | 31.5 |
11 (C) | 175.1 |
12 (CH) | 159 |
13 (CH3) | 17.9 |