| SpectraBase Spectrum ID |
45c6WHowoM8 |
| Name |
N-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxybenzyl]thiocarbamic acid O-cyano ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18N2O6S |
| InChI |
InChI=1S/C15H18N2O6S/c1-8-11(18)12(19)13(20)14(22-8)23-10-4-2-9(3-5-10)6-17-15(24)21-7-16/h2-5,8,11-14,18-20H,6H2,1H3,(H,17,24)/t8-,11-,12+,13+,14-/m0/s1 |
| InChIKey |
NYQKSLDPYVPTRT-CNJBRALLSA-N |
| Molecular Weight |
354.377 g/mol |
| SMILES |
O[C@]1([C@]([C@](Oc2ccc(CNC(OC#N)=S)cc2)(O[C@]([C@@]1(O)[H])(C)[H])[H])(O)[H])[H] |
| SPLASH |
splash10-0a4i-0900000000-a771555870591338fd7b |
| Source of Spectrum |
G4-60-1321-1 |
| Synonyms |
N-[[4-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]phenyl]methyl]carbamothioic acid O-cyano ester
O-cyano N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxyphenyl]methyl]carbamothioate
O-cyano N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate
O-cyano N-[[4-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]methyl]carbamothioate |
| Wiley ID |
1607000 |
![N-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxybenzyl]thiocarbamic acid O-cyano ester](/api/spectrum/45c6WHowoM8/structure.png?h=300&w=458 "N-[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxybenzyl]thiocarbamic acid O-cyano ester")
