| SpectraBase Spectrum ID |
7pq95ENSNjb |
| Name |
anti-1,2,8-Trideoxy-8-iodo-4,5:6,7-bis-O-(1-methylethylidene)-1-phenyl-D-glycero-D-gulo-oct-1-ynitol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25IO5 |
| InChI |
InChI=1S/C20H25IO5/c1-19(2)23-15(12-21)17(25-19)18-16(24-20(3,4)26-18)14(22)11-10-13-8-6-5-7-9-13/h5-9,14-18,22H,12H2,1-4H3/t14-,15+,16-,17+,18+/m0/s1 |
| InChIKey |
MRPYRWUOZBOHMB-IGKNDFSCSA-N |
| Molecular Weight |
472.319 g/mol |
| SMILES |
O[C@@](C#Cc1ccccc1)([C@]1([C@]([C@@]2(OC(C)(C)O[C@@]2(CI)[H])[H])(OC(C)(C)O1)[H])[H])[H] |
| SPLASH |
splash10-0a4r-0980000000-93ea24f5e9f93d2bcc81 |
| Source of Spectrum |
KC-57-4737-16 |
| Wiley ID |
1624277 |
