N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}tetrahydro-2-furanyl]methyl}-4-methylbenzenesulfonamide
9178
Reference
N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}tetrahydro-2-furanyl]methyl}-4-methylbenzenesulfonamide Structure
Systematic / IUPAC Name: N-[[(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]oxolan-2-yl]methyl]-4-methylbenzenesulfonamide
ID: Reference9178
Other Names: NAT19-353947
Formula: C23H30N4O6S
Spectral Data
N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl}tetrahydro-2-furanyl]methyl}-4-methylbenzenesulfonamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP FAIMS |
| No. of Spectral Trees | 2 |
| No. of Spectra | 3678 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/2/2019 1:46:14 PM |
Identificators
| InChI | InChI=1S/C23H30N4O6S/c1-16-5-7-17(8-6-16)34(31,32)25-15-19-23(30)22(29)18(33-19)14-21(28)27-12-10-26(11-13-27)20-4-2-3-9-24-20/h2-9,18-19,22-23,25,29-30H,10-15H2,1H3/t18-,19+,22-,23+/m0/s1 |
| InChI Key | QBTDKFBGPWKSRF-JFSTXAPLSA-N |
| Canonical SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC2C(C(C(O2)CC(=O)N3CCN(CC3)C4=CC=CC=N4)O)O |
| CAS | |
| Splash | |
| Other Names | NAT19-353947 |