| General Compound Information |
|
| BXGC Id |
BXGC0003235 |
| Compound Name |
Linonin |
| Structure |
 |
| Formula |
C26H30O8 |
| InchiKey |
KBDSLGBFQAGHBE-MSGMIQHVSA-N |
| SMILES |
CC1(C)O[C@H]2CC(=O)OC[C@@]22[C@H]1CC(=O)[C@]1(C)[C@@H]2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)C1=COC=C1 |
| Inchi |
InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1 |
| IUPAC |
(1R,2R,7S,10R,13R,14R,16S,19R,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,?.02,1?.01?,1?.01?,2?]docosane-5,12,17-trione |
| Molecular Weight |
470.52 |
| Pubchem Id |
179651 |
| Chembl Id |
CHEMBL517449 |