| Properties | Image |
| MNX_ID | MNXM27042 |
 |
| reference | lipidmapsM:LMPK12113351 |
| formula | C20H16O9 |
| global charge | 0 |
| mol weight | 400.339 |
| InChIKey | QIQROODGFFUJKS-UHFFFAOYSA-N |
| InChI | InChI=1S/C20H16O9/c1-22-15-12-13(21)17(23-2)14(9-4-5-10-11(6-9)26-7-25-10)29-16(12)18(24-3)20-19(15)27-8-28-20/h4-6H,7-8H2,1-3H3 |
| SMILES | COC1=C(C2=CC=C3OCOC3=C2)OC2=C(OC)C3=C(OCO3)C(OC)=C2C1=O |
MNX internals
| InChI (mnx) | InChI=1/C20H16O9/c1-22-15-12-13(21)17(23-2)14(9-4-5-10-11(6-9)26-7-25-10)29-16(12)18(24-3)20-19(15)27-8-28-20/h4-6H,7-8H2,1-3H3 |
 |
| SMILES (mnx) | [CH3:1][O:22][C:15]1=[C:19]2[C:20](=[C:18]([O:24][CH3:3])[C:16]3=[C:12]1[C:13](=[O:21])[C:17]([O:23][CH3:2])=[C:14]([C:9]1=[CH:6][C:11]4=[C:10]([CH:5]=[CH:4]1)[O:25][CH2:7][O:26]4)[O:29]3)[O:28][CH2:8][O:27]2 |
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