| Properties | Image |
|---|
| MNX_ID | MNXM64367 |
 |
| reference | chebi:185367 |
| formula | C23H30O9 |
| global charge | 0 |
| mol weight | 450.484 |
| InChIKey | RWOHROIADKDRDD-XESBKENASA-N |
| InChI | InChI=1S/C23H30O9/c1-10-7-17-22(28)11(2)8-15(27)9-16(22)19-21(6,31-14(5)26)20(30-13(4)25)23(17,32-19)18(10)29-12(3)24/h7,11,16-20,28H,8-9H2,1-6H3/t11-,16-,17?,18+,19-,20-,21-,22-,23-/m1/s1 |
| SMILES | CC(=O)O[C@@H]1[C@](C)(OC(C)=O)[C@@H]2O[C@@]13C(C=C(C)[C@@H]3OC(C)=O)[C@@]1(O)[C@H](C)CC(=O)C[C@H]21 |
MNX internals
| InChI (mnx) | InChI=1/C23H30O9/c1-10-7-17-22(28)11(2)8-15(27)9-16(22)19-21(6,31-14(5)26)20(30-13(4)25)23(17,32-19)18(10)29-12(3)24/h7,11,16-20,28H,8-9H2,1-6H3/t11-,16-,17?,18+,19-,20-,21-,22-,23-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:10]1=[CH:7][CH:17]2[C@@:22]3([OH:28])[C@H:11]([CH3:2])[CH2:8][C:15](=[O:27])[CH2:9][C@@H:16]3[C@@H:19]3[C@@:21]([CH3:6])([O:31][C:14]([CH3:5])=[O:26])[C@@H:20]([O:30][C:13]([CH3:4])=[O:25])[C@@:23]2([C@H:18]1[O:29][C:12]([CH3:3])=[O:24])[O:32]3 |
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