| Properties | Image |
|---|
| MNX_ID | MNXM1129046 |
 |
| reference | chebi:168822 |
| formula | C17H24O11 |
| global charge | 0 |
| mol weight | 404.368 |
| InChIKey | XSCVKBFEPYGZSL-JYVCFIOWSA-N |
| InChI | InChI=1S/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6,8,10,12-14,16-18,21-23H,4-5H2,1-2H3,(H,19,20)/b7-3+/t8-,10+,12+,13-,14+,16-,17-/m0/s1 |
| SMILES | C/C=C1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C17H24O11/c1-3-7-8(4-11(19)20)9(15(24)25-2)6-26-16(7)28-17-14(23)13(22)12(21)10(5-18)27-17/h3,6,8,10,12-14,16-18,21-23H,4-5H2,1-2H3,(H,19,20)/b7-3+/t8-,10+,12+,13-,14+,16-,17-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1]/[CH:3]=[C:7]1\[C@H:8]([CH2:4][C:11](=[O:19])[OH:20])[C:9]([C:15](=[O:24])[O:25][CH3:2])=[CH:6][O:26][C@H:16]1[O:28][C@H:17]1[C@H:14]([OH:23])[C@@H:13]([OH:22])[C@H:12]([OH:21])[C@@H:10]([CH2:5][OH:18])[O:27]1 |
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