| Properties | Image |
|---|
| MNX_ID | MNXM102007 |
 |
| reference | chebi:69451 |
| formula | C26H22O10 |
| global charge | 0 |
| mol weight | 494.452 |
| InChIKey | XBXVVTMNRUIPIX-ZEQKJWHPSA-N |
| InChI | InChI=1S/C26H22O10/c1-32-21-6-13(7-22(33-2)25(21)31)26-23(11-27)34-17-4-3-12(5-19(17)36-26)18-10-16(30)24-15(29)8-14(28)9-20(24)35-18/h3-10,23,26-29,31H,11H2,1-2H3/t23-,26-/m1/s1 |
| SMILES | COC1=CC([C@H]2OC3=CC(C4=CC(=O)C5=C(C=C(O)C=C5O)O4)=CC=C3O[C@@H]2CO)=CC(OC)=C1O |
MNX internals
| InChI (mnx) | InChI=1/C26H22O10/c1-32-21-6-13(7-22(33-2)25(21)31)26-23(11-27)34-17-4-3-12(5-19(17)36-26)18-10-16(30)24-15(29)8-14(28)9-20(24)35-18/h3-10,23,26-29,31H,11H2,1-2H3/t23-,26-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][O:32][C:21]1=[C:25]([OH:31])[C:22]([O:33][CH3:2])=[CH:7][C:13]([C@@H:26]2[C@@H:23]([CH2:11][OH:27])[O:34][C:17]3=[C:19]([CH:5]=[C:12]([C:18]4=[CH:10][C:16](=[O:30])[C:24]5=[C:15]([OH:29])[CH:8]=[C:14]([OH:28])[CH:9]=[C:20]5[O:35]4)[CH:3]=[CH:4]3)[O:36]2)=[CH:6]1 |
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