| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM105025 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C36H44O12 |
| charge | 0 |
| mass | 668.28328 |
| reference | chebi:69715 |
| InChIKey | SRKVJOIQCZXSCT-PQTFDODOSA-N |
| InChI | InChI=1S/C36H44O12/c1-9-26(41)45-28-19(2)17-36(48-22(5)39)27(28)30(44-20(3)37)35-18-43-34(8,32(36)46-31(42)23-13-11-10-12-14-23)29(35)24(15-16-25(35)40)33(6,7)47-21(4)38/h10-16,19,24,27-30,32H,9,17-18H2,1-8H3/t19-,24-,27+,28-,29-,30+,32-,34+,35+,36+/m0/s1 |
| SMILES | CCC(=O)O[C@H]1[C@@H](C)C[C@]2(OC(C)=O)[C@@H](OC(=O)c3ccccc3)[C@]3(C)OC[C@]4(C(=O)C=C[C@H](C(C)(C)OC(C)=O)[C@H]43)[C@H](OC(C)=O)[C@@H]12 |
|
