| SpectraBase Spectrum ID |
K8AgfQpDfMc |
| Name |
.beta.-D-Ribofuranoside, phenylmethyl 2,3-o-(1-methylethylidene)-5-o-(2,3,4,6-tetra-o-acetyl-.beta.-D-gluco pyranosyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
610.226155890 u |
| Formula |
C29H38O14 |
| InChI |
InChI=1S/C29H38O14/c1-15(30)34-13-20-22(37-16(2)31)24(38-17(3)32)25(39-18(4)33)27(40-20)36-14-21-23-26(43-29(5,6)42-23)28(41-21)35-12-19-10-8-7-9-11-19/h7-11,20-28H,12-14H2,1-6H3/t20-,21-,22-,23-,24+,25-,26-,27-,28-/m1/s1 |
| InChIKey |
AEHKMDWHKFVDLU-YPZCPXAHSA-N |
| Molecular Weight |
610.609 g/mol |
| SMILES |
[C@]12([C@@]([C@@](CO[C@]3([C@@]([C@@](OC(=O)C)([C@@]([C@](O3)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])(O[C@]1(OCC=1C=CC=CC1)[H])[H])(OC(O2)(C)C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949513 |
