| SpectraBase Spectrum ID |
BIzVLxKN6H2 |
| Name |
3,4,5,6-tetra-O-benzyl-1,2-di-O-hexyl-scyllo-inositol |
| Alternate Name(s) |
({[(1R,2S,3S,4R,5S,6S)-2,3,4-tris(benzyloxy)-5,6-bis(hexyloxy)cyclohexyl]oxy}methyl)benzene |
| CAS Registry Number |
135096-74-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C46H60O6 |
| InChI |
InChI=1S/C46H60O6/c1-3-5-7-21-31-47-41-42(48-32-22-8-6-4-2)44(50-34-38-25-15-10-16-26-38)46(52-36-40-29-19-12-20-30-40)45(51-35-39-27-17-11-18-28-39)43(41)49-33-37-23-13-9-14-24-37/h9-20,23-30,41-46H,3-8,21-22,31-36H2,1-2H3/t41-,42-,43+,44+,45-,46-/m0/s1 |
| InChIKey |
OQIMFCQYZYMUKK-MLSOJYHGSA-N |
| Molecular Weight |
708.980 g/mol |
| SMILES |
[C@@]1([C@]([C@](OCc2ccccc2)([C@]([C@@]([C@]1(OCc1ccccc1)[H])(OCCCCCC)[H])(OCCCCCC)[H])[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H] |
| SPLASH |
splash10-0006-9000000000-2beb7efdc3965aee5833 |
| Source of Spectrum |
K-124-2276-19 |
| Wiley ID |
1415298 |
