| SpectraBase Spectrum ID |
ITnzFOxwcYA |
| Name |
Mycaperoxide A Methyl Ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H44O5 |
| InChI |
InChI=1S/C25H44O5/c1-17-9-10-20-22(3,4)12-8-13-25(20,27)24(17,6)16-15-23(5)14-11-19(29-30-23)18(2)21(26)28-7/h17-20,27H,8-16H2,1-7H3/t17-,18+,19+,20+,23+,24-,25+/m1/s1 |
| InChIKey |
VRRYXSNRFRFOLZ-INXNGHJVSA-N |
| Molecular Weight |
424.622 g/mol |
| SMILES |
O[C@]12[C@](CC[C@]3(OO[C@]([C@@](C(=O)OC)(C)[H])(CC3)[H])C)([C@](C)(CC[C@]1(C(C)(C)CCC2)[H])[H])C |
| SPLASH |
splash10-01b9-9600200000-cc5c7cbda161d2934b31 |
| Source of Spectrum |
J-58-3001-4 |
| Synonyms |
(S)-2-{6-[2-((1R,2R,4aS,8aS)-8a-Hydroxy-1,2,5,5-tetramethyl-decahydro-naphthalen-1-yl)-ethyl]-6-methyl-[1,2]dioxan-3-yl}-propionic acid methyl ester
Methyl (2S)-2-(6-{2-[(1R,2R,8aS)-1-hydroxy-2,5,5,8a-tetramethyldecahydro-1-naphthalenyl]ethyl}-6-methyl-1,2-dioxan-3-yl)propanoate
Mycaperoxide B MethylEster |
| Wiley ID |
1379383 |
