| SpectraBase Spectrum ID |
95f6BDL5JTd |
| Name |
Ethyl 4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(5-hydroxy-4(S)-methylpent-2-enyl)tetrahydropyran-2-yl]-3-methylbut-2(E)-enoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O6 |
| InChI |
InChI=1S/C18H30O6/c1-4-23-16(20)9-13(3)8-15-18(22)17(21)14(11-24-15)7-5-6-12(2)10-19/h5-6,9,12,14-15,17-19,21-22H,4,7-8,10-11H2,1-3H3/b6-5+,13-9+/t12-,14-,15-,17+,18-/m0/s1 |
| InChIKey |
RADLDANVKVFFJP-HKINFSKQSA-N |
| Molecular Weight |
342.432 g/mol |
| SMILES |
O[C@@]1([C@](CO[C@]([C@@]1(O)[H])(C\C(=C\C(=O)OCC)C)[H])(C\C=C\[C@@](CO)(C)[H])[H])[H] |
| SPLASH |
splash10-001i-9004000000-23db7e13d44543c5b470 |
| Source of Spectrum |
F-50-10745-9 |
| Synonyms |
ethyl (2E)-5,9-anhydro-2,3,4,8-tetradeoxy-8-[(2E,4S)-5-hydroxy-4-methyl-2-pentenyl]-3-methyl-L-talo-non-2-enonate |
| Wiley ID |
789412 |
![Ethyl 4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(5-hydroxy-4(S)-methylpent-2-enyl)tetrahydropyran-2-yl]-3-methylbut-2(E)-enoate](/api/spectrum/95f6BDL5JTd/structure.png?h=300&w=458 "Ethyl 4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(5-hydroxy-4(S)-methylpent-2-enyl)tetrahydropyran-2-yl]-3-methylbut-2(E)-enoate")
