| SpectraBase Spectrum ID |
EEjpTHYouSz |
| Name |
8(r,s)-8-hydroxy-7-oxo-8,9-seco-labdan-15-oic acid |
| Alternate Name(s) |
6-{2-[(3R)-3-hydroxy-2-oxobutyl]-1,3,3-trimethylcyclohexyl}-3-methylhexanoic acid |
| CAS Registry Number |
108945-06-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H36O4 |
| InChI |
InChI=1S/C20H36O4/c1-14(12-18(23)24)8-6-10-20(5)11-7-9-19(3,4)17(20)13-16(22)15(2)21/h14-15,17,21H,6-13H2,1-5H3,(H,23,24)/t14?,15-,17?,20?/m1/s1 |
| InChIKey |
MUWYECVUJOAOSM-HZHPEIPNSA-N |
| Molecular Weight |
340.504 g/mol |
| SMILES |
O[C@@](C(CC1C(CCCC(CC(=O)O)C)(CCCC1(C)C)C)=O)(C)[H] |
| SPLASH |
splash10-00sr-9400000000-b6777d979b793f74c193 |
| Source of Spectrum |
F-42-4574-27 |
| Wiley ID |
1335355 |
