| Properties | Image |
| MNX_ID | MNXM163700 |
 |
| reference | metacycM:CPD-18186 |
| formula | C16H16O7 |
| global charge | 0 |
| mol weight | 320.297 |
| InChIKey | PODQBZJWKPDHDN-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H16O7/c1-7(18)4-8-9(6-17)15(20)12-10(22-2)5-11(23-3)16(21)13(12)14(8)19/h5,17,21H,4,6H2,1-3H3 |
| SMILES | COC1=CC(OC)=C(O)C2=C1C(=O)C(CO)=C(CC(C)=O)C2=O |
MNX internals
| InChI (mnx) | InChI=1/C16H16O7/c1-7(18)4-8-9(6-17)15(20)12-10(22-2)5-11(23-3)16(21)13(12)14(8)19/h5,17,21H,4,6H2,1-3H3 |
 |
| SMILES (mnx) | [CH3:1][C:7]([CH2:4][C:8]1=[C:9]([CH2:6][OH:17])[C:15](=[O:20])[C:12]2=[C:13]([C:14]1=[O:19])[C:16]([OH:21])=[C:11]([O:23][CH3:3])[CH:5]=[C:10]2[O:22][CH3:2])=[O:18] |
|