| Properties | Image |
|---|
| MNX_ID | MNXM164304 |
 |
| reference | metacycM:CPD-19398 |
| formula | C23H18O9 |
| global charge | 0 |
| mol weight | 438.388 |
| InChIKey | MCIXGBCAADINCO-UHFFFAOYSA-N |
| InChI | InChI=1S/C23H18O9/c1-8-14-9(6-12(30-2)15(8)23(29)32-4)5-10-16(21(14)27)22(28)17-11(24)7-13(31-3)20(26)18(17)19(10)25/h5-7,24,26-27H,1-4H3 |
| SMILES | COC(=O)C1=C(C)C2=C(C=C1OC)C=C1C(=O)C3=C(O)C(OC)=CC(O)=C3C(=O)C1=C2O |
MNX internals
| InChI (mnx) | InChI=1/C23H18O9/c1-8-14-9(6-12(30-2)15(8)23(29)32-4)5-10-16(21(14)27)22(28)17-11(24)7-13(31-3)20(26)18(17)19(10)25/h5-7,24,26-27H,1-4H3 |
 |
| SMILES (mnx) | [CH3:1][C:8]1=[C:15]([C:23](=[O:29])[O:32][CH3:4])[C:12]([O:30][CH3:2])=[CH:6][C:9]2=[CH:5][C:10]3=[C:16]([C:21]([OH:27])=[C:14]12)[C:22](=[O:28])[C:17]1=[C:18]([C:19]3=[O:25])[C:20]([OH:26])=[C:13]([O:31][CH3:3])[CH:7]=[C:11]1[OH:24] |
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