| SpectraBase Spectrum ID |
DbhK9jWcNEu |
| Name |
(2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[(1R,5S)-4-keto-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-5-carbonyl]-2H-pyridine-5-carboxylic acid methyl ester |
| Alternate Name(s) |
(2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[oxo-[(1R,5S)-1,8,8-trimethyl-4-oxo-3-oxabicyclo[3.2.1]octan-5-yl]methyl]-2H-pyridine-5-carboxylic acid methyl ester
Methyl (2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[(1R,5S)-1,8,8-trimethyl-4-oxo-3-oxabicyclo[3.2.1]octane-5-carbonyl]-2H-pyridine-5-carboxylate
Methyl (2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[[(1R,5S)-1,8,8-trimethyl-4-oxidanylidene-3-oxabicyclo[3.2.1]octan-5-yl]carbonyl]-2H-pyridine-5-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H31NO7 |
| InChI |
InChI=1S/C23H31NO7/c1-21(2)22(3)9-10-23(21,20(27)31-14-22)19(26)24-13-15(18(25)28-4)5-6-16(24)7-8-17-29-11-12-30-17/h5-6,13,16-17H,7-12,14H2,1-4H3/t16-,22+,23+/m1/s1 |
| InChIKey |
AOFDHBLBIIDZSW-XARZLDAJSA-N |
| Molecular Weight |
433.501 g/mol |
| SMILES |
C1=C(C=C[C@@](N1C(=O)[C@@]12C(OC[C@](CC2)(C1(C)C)C)=O)(CCC1OCCO1)[H])C(=O)OC |
| SPLASH |
splash10-0002-0901000000-6bd35e3d6a3d93accd62 |
| Source of Spectrum |
KC-60-312-17 |
| Wiley ID |
1582851 |
![(2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[(1R,5S)-4-keto-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-5-carbonyl]-2H-pyridine-5-carboxylic acid methyl ester](/api/spectrum/DbhK9jWcNEu/structure.png?h=300&w=458 "(2S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-1-[(1R,5S)-4-keto-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-5-carbonyl]-2H-pyridine-5-carboxylic acid methyl ester")
