| SpectraBase Spectrum ID |
9JtaQudByXq |
| Name |
Ethyl (1'S,2R,2"R,5'R,8'S)-2-[2'-(1"-Hydroxybutan-2"-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]oct-8'-yl]-3-oxahex-5-enoate |
| Alternate Name(s) |
Ethyl (1'S,2R,2''R,5'R,8'S)-2-[2'-(1''-Hydroxybutan-2''-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]oct-8'-yl]-3-oxahex-5-enoate
ethyl (2R)-{(3aR,6S,6aS)-1-[1-(hydroxymethyl)propyl]tetrahydro-1H,3H-furo[3,4-c]isoxazol-6-yl}(allyloxy)ethanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H27NO6 |
| InChI |
InChI=1S/C16H27NO6/c1-4-7-21-15(16(19)20-6-3)14-13-11(9-22-14)10-23-17(13)12(5-2)8-18/h4,11-15,18H,1,5-10H2,2-3H3/t11-,12?,13+,14+,15-/m1/s1 |
| InChIKey |
ULAXEJBKCAQPGB-NAEJHUAPSA-N |
| Molecular Weight |
329.393 g/mol |
| SMILES |
OCC(N1[C@@]2([C@@]([C@](C(=O)OCC)(OCC=C)[H])(OC[C@@]2(CO1)[H])[H])[H])CC |
| SPLASH |
splash10-0002-0090000000-84d9f0a1fdaa54355152 |
| Source of Spectrum |
KC-0-3722-9 |
| Wiley ID |
826947 |
![Ethyl (1'S,2R,2"R,5'R,8'S)-2-[2'-(1"-Hydroxybutan-2"-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]oct-8'-yl]-3-oxahex-5-enoate](/api/spectrum/9JtaQudByXq/structure.png?h=300&w=458 "Ethyl (1'S,2R,2\"R,5'R,8'S)-2-[2'-(1\"-Hydroxybutan-2\"-yl)-3',7'-dioxa-2'-azabicyclo[3.3.0]oct-8'-yl]-3-oxahex-5-enoate")
