| SpectraBase Spectrum ID |
HfmdfSO3E3w |
| Name |
(3S,4R,5R,6S)-1-(4-hydroxybutyl)azepane-3,4,5,6-tetrol |
| Alternate Name(s) |
(3S,4R,5R,6S)-1-N-(4-Hydroxymethyl)propyl-3,4,5,6-tetrahydroxyazepane
(3S,4R,5R,6S)-1-(4-oxidanylbutyl)azepane-3,4,5,6-tetrol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H21NO5 |
| InChI |
InChI=1S/C10H21NO5/c12-4-2-1-3-11-5-7(13)9(15)10(16)8(14)6-11/h7-10,12-16H,1-6H2/t7-,8-,9+,10+/m0/s1 |
| InChIKey |
PQWYUEFSJZPCKY-AXTSPUMRSA-N |
| Molecular Weight |
235.280 g/mol |
| SMILES |
O[C@@]1([C@]([C@@]([C@](CN(C1)CCCCO)(O)[H])(O)[H])(O)[H])[H] |
| SPLASH |
splash10-00or-0910000000-9866bb578568decd7553 |
| Source of Spectrum |
Y1-38-1319-5 |
| Wiley ID |
1527905 |
