| SpectraBase Spectrum ID |
BbKWhmCQUGc |
| Name |
.alpha.-D-Glucopyranoside, 2,3,4,6-tetra-o-benzoyl-.alpha.-D-glucopyranosyl, tetrabenzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
1174.325929500 u |
| Formula |
C68H54O19 |
| InChI |
InChI=1S/C68H54O19/c69-59(43-25-9-1-10-26-43)77-41-51-53(81-61(71)45-29-13-3-14-30-45)55(83-63(73)47-33-17-5-18-34-47)57(85-65(75)49-37-21-7-22-38-49)67(79-51)87-68-58(86-66(76)50-39-23-8-24-40-50)56(84-64(74)48-35-19-6-20-36-48)54(82-62(72)46-31-15-4-16-32-46)52(80-68)42-78-60(70)44-27-11-2-12-28-44/h1-40,51-58,67-68H,41-42H2/t51-,52+,53-,54+,55+,56-,57-,58+,67-,68?/m0/s1 |
| InChIKey |
DQVRLLCYXKHLPX-QFJGKTBJSA-N |
| Molecular Weight |
1175.161 g/mol |
| SMILES |
[C@]1([C@@]([C@@](OC(=O)C2=CC=CC=C2)([C@@](O[C@]1(OC1[C@@]([C@@](OC(=O)C2=CC=CC=C2)([C@@]([C@](O1)(COC(=O)C1=CC=CC=C1)[H])(OC(=O)C1=CC=CC=C1)[H])[H])(OC(=O)C1=CC=CC=C1)[H])[H])(COC(=O)C=1C=CC=CC1)[H])[H])(OC(=O)C1=CC=CC=C1)[H])(OC(=O)C=1C=CC=CC1)[H] |
