SpectraBase Spectrum ID |
4JRCu8oYySB |
Name |
.beta.-D-Glucopyranoside, methyl 2,3-bis-o-(methoxymethyl)-4,6-o-(phenylmethylene)-, (R)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
542.197439221 u |
Formula |
C29H34O8S |
InChI |
InChI=1S/C29H34O8S/c1-33-29-27(36-20-23-16-10-5-11-17-23)25(35-19-22-14-8-4-9-15-22)24(26(37-29)28(30)38(2,31)32)34-18-21-12-6-3-7-13-21/h3-17,24-30H,18-20H2,1-2H3/t24-,25-,26-,27+,28?,29-/m0/s1 |
InChIKey |
BIBKLTVCWLYTFM-DFQVKVHASA-N |
Molecular Weight |
542.643 g/mol |
SMILES |
[C@]1(C(S(=O)(=O)C)O)([C@]([C@](OCC2=CC=CC=C2)([C@]([C@](O1)(OC)[H])(OCC=1C=CC=CC1)[H])[H])(OCC=1C=CC=CC1)[H])[H] |