SpectraBase Spectrum ID |
5GhBXgZb5ER |
Name |
Decanoic acid, 10-(benzoyloxy)-5-hydroxy-4,6-dimethoxy-2,8-dimethyl-, methyl ester, [2R-(2R*,4S*,5R*,6S*,8S*)]- |
CAS Registry Number |
118299-11-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H34O7 |
InChI |
InChI=1S/C22H34O7/c1-15(11-12-29-22(25)17-9-7-6-8-10-17)13-18(26-3)20(23)19(27-4)14-16(2)21(24)28-5/h6-10,15-16,18-20,23H,11-14H2,1-5H3/t15-,16+,18-,19-,20+/m0/s1 |
InChIKey |
IRWQYFFFKSTYMK-HHUCQEJWSA-N |
Molecular Weight |
410.507 g/mol |
SMILES |
O[C@@]([C@](C[C@](C(=O)OC)(C)[H])(OC)[H])([C@](C[C@](CCOC(=O)c1ccccc1)(C)[H])(OC)[H])[H] |
SPLASH |
splash10-0002-9500000000-438b9b24d627cc6f12c7 |
Source of Spectrum |
J-55-2784-34 |
Synonyms |
(3S,5S,6R,7S,9R)-6-hydroxy-5,7,10-trimethoxy-3,9-dimethyl-10-oxodecyl benzoate
[2R-(2R*,4S*,5R*,6S*,8S*)]-10-(benzoyloxy)-5-hydroxy-4,6-dimethoxy-2,8-dimethyldecanoic acid methyl ester |
Wiley ID |
1373629 |