| SpectraBase Spectrum ID |
IoBcff8gBw7 |
| Name |
cyclohexanehexanoic acid, 2-[2-(acetyloxy)-3-oxobutyl]-.beta.-hydroxy-.beta.,1,3,3-tetramethyl-.epsilon.-oxo, methyl ester, [1S-[1.alpha.(R*),2.beta.(R*)]]- |
| CAS Registry Number |
102505-52-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H38O7 |
| InChI |
InChI=1S/C23H38O7/c1-15(24)17(30-16(2)25)13-18-21(3,4)10-8-11-23(18,6)19(26)9-12-22(5,28)14-20(27)29-7/h17-18,28H,8-14H2,1-7H3/t17-,18-,22-,23-/m0/s1 |
| InChIKey |
AGKWGGSTZDUTOM-PTRHGPIFSA-N |
| Molecular Weight |
426.550 g/mol |
| SMILES |
O[C@](CC(=O)OC)(CCC([C@@]1([C@@](C[C@](OC(=O)C)(C(=O)C)[H])(C(CCC1)(C)C)[H])C)=O)C |
| SPLASH |
splash10-06dm-7911000000-b1a6cdffdde7f738ffa0 |
| Source of Spectrum |
J-51-2826-9 |
| Synonyms |
Methyl (3S)-6-{(1S,2S)-2-[(2S)-2-(acetyloxy)-3-oxobutyl]-1,3,3-trimethylcyclohexyl}-3-hydroxy-3-methyl-6-oxohexanoate |
| Wiley ID |
1379929 |
![cyclohexanehexanoic acid, 2-[2-(acetyloxy)-3-oxobutyl]-.beta.-hydroxy-.beta.,1,3,3-tetramethyl-.epsilon.-oxo, methyl ester, [1S-[1.alpha.(R*),2.beta.(R*)]]-](/api/spectrum/IoBcff8gBw7/structure.png?h=300&w=458 "cyclohexanehexanoic acid, 2-[2-(acetyloxy)-3-oxobutyl]-.beta.-hydroxy-.beta.,1,3,3-tetramethyl-.epsilon.-oxo, methyl ester, [1S-[1.alpha.(R*),2.beta.(R*)]]-")
