SpectraBase Spectrum ID |
1QuZhwLIUrH |
Name |
(2S)-2-(2,3,4,6-Tetra-O-acetyl-.beta.,D-glucopyranosyloxy)-2H-1,4-benzoxazin-3(4H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H25NO12 |
InChI |
InChI=1S/C22H25NO12/c1-10(24)29-9-16-17(30-11(2)25)18(31-12(3)26)19(32-13(4)27)21(34-16)35-22-20(28)23-14-7-5-6-8-15(14)33-22/h5-8,16-19,21-22H,9H2,1-4H3,(H,23,28)/t16-,17-,18+,19-,21+,22+/m1/s1 |
InChIKey |
FVNUMIHMVXSEGV-BHNQRHOYSA-N |
Molecular Weight |
495.437 g/mol |
SMILES |
N1c2c(O[C@](C1=O)(O[C@]1([C@@]([C@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])[H])cccc2 |
SPLASH |
splash10-05mo-6901000000-10b2f045da1fa82d7cb5 |
Source of Spectrum |
SO-0-1120-8 |
Synonyms |
(2S)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl 2,3,4,6-tetra-O-acetylhexopyranoside |
Wiley ID |
1542757 |