| Properties | Image |
|---|
| MNX_ID | MNXM37820 |
 |
| reference | keggC:C11162 |
| formula | C26H22O10 |
| global charge | 0 |
| mol weight | 494.452 |
| InChIKey | NIOAGUZTTGFPGK-ILBGXUMGSA-N |
| InChI | InChI=1S/C26H22O10/c1-32-19-5-12(3-4-15(19)29)25-23(11-27)36-26-21(33-2)6-13(7-22(26)35-25)18-10-17(31)24-16(30)8-14(28)9-20(24)34-18/h3-10,23,25,27-30H,11H2,1-2H3/t23-,25-/m1/s1 |
| SMILES | COC1=CC([C@H]2OC3=C(O[C@@H]2CO)C(OC)=CC(C2=CC(=O)C4=C(O)C=C(O)C=C4O2)=C3)=CC=C1O |
MNX internals
| InChI (mnx) | InChI=1/C26H22O10/c1-32-19-5-12(3-4-15(19)29)25-23(11-27)36-26-21(33-2)6-13(7-22(26)35-25)18-10-17(31)24-16(30)8-14(28)9-20(24)34-18/h3-10,23,25,27-30H,11H2,1-2H3/t23-,25-/m1/s1 |
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| SMILES (mnx) | [CH3:1][O:32][C:19]1=[C:15]([OH:29])[CH:4]=[CH:3][C:12]([C@@H:25]2[C@@H:23]([CH2:11][OH:27])[O:36][C:26]3=[C:21]([O:33][CH3:2])[CH:6]=[C:13]([C:18]4=[CH:10][C:17](=[O:31])[C:24]5=[C:16]([OH:30])[CH:8]=[C:14]([OH:28])[CH:9]=[C:20]5[O:34]4)[CH:7]=[C:22]3[O:35]2)=[CH:5]1 |
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