SpectraBase Spectrum ID |
LqHMU3TncOe |
Name |
N-Formylantimycic acid methyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
296.100836237 u |
Formula |
C13H16N2O6 |
InChI |
InChI=1S/C13H16N2O6/c1-7(17)10(13(20)21-2)15-12(19)8-4-3-5-9(11(8)18)14-6-16/h3-7,10,17-18H,1-2H3,(H,14,16)(H,15,19)/t7-,10+/m1/s1 |
InChIKey |
FKDSAXOHMLWBNA-XCBNKYQSSA-N |
Molecular Weight |
296.279 g/mol |
SMILES |
C1(=CC=CC(=C1O)C(N[C@@]([C@@](C)(O)[H])(C(OC)=O)[H])=O)NC=O |