| Properties | Image |
|---|
| MNX_ID | MNXM109208 |
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| reference | chebi:66208 |
| formula | C22H26O12 |
| global charge | 0 |
| mol weight | 482.438 |
| InChIKey | OHBCQZHHEGRATF-MIUGBVLSSA-N |
| InChI | InChI=1S/C22H26O12/c23-9-17-19(30)20(31)21(34-18(29)6-10-1-2-12(24)14(26)5-10)22(33-17)32-4-3-11-7-15(27)16(28)8-13(11)25/h1-2,5,7-8,17,19-28,30-31H,3-4,6,9H2/t17-,19-,20+,21-,22-/m1/s1 |
| SMILES | O=C(CC1=CC=C(O)C(O)=C1)O[C@H]1[C@H](OCCC2=CC(O)=C(O)C=C2O)O[C@H](CO)[C@@H](O)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C22H26O12/c23-9-17-19(30)20(31)21(34-18(29)6-10-1-2-12(24)14(26)5-10)22(33-17)32-4-3-11-7-15(27)16(28)8-13(11)25/h1-2,5,7-8,17,19-28,30-31H,3-4,6,9H2/t17-,19-,20+,21-,22-/m1/s1 |
 |
| SMILES (mnx) | [CH:1]1=[CH:2][C:12]([OH:24])=[C:14]([OH:26])[CH:5]=[C:10]1[CH2:6][C:18](=[O:29])[O:34][C@@H:21]1[C@@H:20]([OH:31])[C@H:19]([OH:30])[C@@H:17]([CH2:9][OH:23])[O:33][C@H:22]1[O:32][CH2:4][CH2:3][C:11]1=[CH:7][C:15]([OH:27])=[C:16]([OH:28])[CH:8]=[C:13]1[OH:25] |
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