| SpectraBase Spectrum ID |
ArM3poUp2mA |
| Name |
Villiramulin A (S)-(+)-O-Methylmandelic Acid Ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H34O5 |
| InChI |
InChI=1S/C28H34O5/c1-22(33-28(29)27(30-2)24-16-12-9-13-17-24)14-10-7-5-3-4-6-8-11-15-23-18-19-25-26(20-23)32-21-31-25/h3-4,6,8-9,12-13,16-20,22,27H,5,7,10-11,14-15,21H2,1-2H3/b4-3+,8-6+/t22-,27?/m0/s1 |
| InChIKey |
HPZMEBALIOBBIC-WNACDCPHSA-N |
| Molecular Weight |
450.575 g/mol |
| SMILES |
C(C(c1ccccc1)OC)(O[C@](CCCC\C=C\C=C\CCc1cc2OCOc2cc1)(C)[H])=O |
| SPLASH |
splash10-00dr-3900000000-a3699a51493515bb9bbb |
| Source of Spectrum |
J-58-7806-6 |
| Synonyms |
(1S,6E,8E)-11-(1,3-benzodioxol-5-yl)-1-methyl-6,8-undecadienyl methoxy(phenyl)acetate |
| Wiley ID |
1387828 |
