| SpectraBase Spectrum ID |
4px3JJDe5JL |
| Name |
3'-Acetoxyglyceryl 8,9-Dioxo-8,9-secolabda-15-oate |
| Alternate Name(s) |
3-(acetyloxy)-2-hydroxypropyl (3R)-3-methyl-6-oxo-6-[(1S,2S)-1,3,3-trimethyl-2-(3-oxobutyl)cyclohexyl]hexanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H42O7 |
| InChI |
InChI=1S/C25H42O7/c1-17(14-23(30)32-16-20(28)15-31-19(3)27)8-11-22(29)25(6)13-7-12-24(4,5)21(25)10-9-18(2)26/h17,20-21,28H,7-16H2,1-6H3/t17-,20?,21+,25+/m1/s1 |
| InChIKey |
FMYLWPZRDWVZRS-ISACJYBNSA-N |
| Molecular Weight |
454.604 g/mol |
| SMILES |
OC(COC(C[C@@](CCC([C@@]1([C@](C(C)(C)CCC1)(CCC(=O)C)[H])C)=O)(C)[H])=O)COC(=O)C |
| SPLASH |
splash10-0006-9000000000-e84513d1c2a6d24d37dd |
| Source of Spectrum |
F-47-9748-7 |
| Wiley ID |
1388779 |
