| SpectraBase Spectrum ID |
Ga4Ejq8atsS |
| Name |
Methyl 8(r,s)-8-acetoxy-7-oxo-8,9-seco-labdan-15-oate |
| CAS Registry Number |
108945-07-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H40O5 |
| InChI |
InChI=1S/C23H40O5/c1-16(14-21(26)27-7)10-8-12-23(6)13-9-11-22(4,5)20(23)15-19(25)17(2)28-18(3)24/h16-17,20H,8-15H2,1-7H3/t16-,17-,20?,23+/m1/s1 |
| InChIKey |
FSBWBYISICQSIJ-GGBCVKENSA-N |
| Molecular Weight |
396.568 g/mol |
| SMILES |
C1(CC([C@](OC(=O)C)(C)[H])=O)[C@@](CCC[C@](CC(=O)OC)(C)[H])(CCCC1(C)C)C |
| SPLASH |
splash10-014r-8900000000-fd74d061c0a0f1b52c31 |
| Source of Spectrum |
F-42-4574-29 |
| Synonyms |
Methyl (3R)-6-{(1S)-2-[(3R)-3-(acetyloxy)-2-oxobutyl]-1,3,3-trimethylcyclohexyl}-3-methylhexanoate |
| Wiley ID |
1367577 |
