| SpectraBase Spectrum ID |
DskV9NzEZri |
| Name |
Inosine, 1-hydroxy-, 2',3',5'-triacetate |
| CAS Registry Number |
79999-38-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18N4O9 |
| InChI |
InChI=1S/C16H18N4O9/c1-7(21)26-4-10-12(27-8(2)22)13(28-9(3)23)16(29-10)19-5-17-14-11(19)15(24)20(25)6-18-14/h5-6,10,12-13,16,25H,4H2,1-3H3/t10-,12-,13-,16-/m1/s1 |
| InChIKey |
SCQPXEHRKSFNOH-XNIJJKJLSA-N |
| Molecular Weight |
410.339 g/mol |
| SMILES |
ON1C(c2[n]([C@]3([C@@]([C@](OC(=O)C)([C@](O3)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H])cnc2N=C1)=O |
| SPLASH |
splash10-0a4i-0090000000-90342100ad004fce05b3 |
| Source of Spectrum |
I-59-2604-0 |
| Synonyms |
2',3',5'-tri-O-acetyl-1-hydroxyinosine
[(2R,3R,4R,5R)-3,4-bis(acetyloxy)-5-(1-hydroxy-6-oxo-6,7-dihydro-1H-purin-7-yl)oxolan-2-yl]methyl acetate |
| Wiley ID |
1373474 |
