| SpectraBase Spectrum ID |
AuI5UmFRQVf |
| Name |
DESULFO-6'-BENZOYL-4-HYDROXYBUTYL-GLUCOSINOLATE |
| Compound Number |
D3 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C25H28NO9S |
| InChI |
InChI=1S/C25H29NO9S/c27-20-18(15-34-24(31)17-11-5-2-6-12-17)35-25(22(29)21(20)28)36-19(26-32)13-7-8-14-33-23(30)16-9-3-1-4-10-16/h1-6,9-12,18,20-22,25,27-29,32H,7-8,13-15H2/b26-19+/t18-,20+,21-,22+,25-/m1/s1 |
| InChIKey |
NLIDHWVYPAKYGU-HMSMOVJASA-N |
| Literature Reference Author |
M.REICHELT,P.D.BROWN,B.SCHNEIDER,N.J.OLDHAM,E.STAUBER,J.TOKU
HISA,D.J.KLIEBENSTEI |
| Literature Reference Citation |
PHYTOCHEM.,59,663(2002) |
| Literature Reference DOI |
10.1016/S0031-9422(02)00014-6 |
| Molecular Weight |
518.559 g/mol |
| Solvent |
DMSO-D6 |
| Source File Reference |
UWVN2771 |
