| Properties | Image |
| MNX_ID | MNXM105383 |
 |
| reference | chebi:68713 |
| formula | C16H16O8 |
| global charge | 0 |
| mol weight | 336.296 |
| InChIKey | DKCFLWCWQILBFZ-DRZCJDIDSA-N |
| InChI | InChI=1S/C16H16O8/c1-22-10-6-9-12(16(21,14(10)19)15(20)23-2)13(18)11-7(17)4-3-5-8(11)24-9/h3-5,10,14,17,19,21H,6H2,1-2H3/t10-,14+,16+/m0/s1 |
| SMILES | COC(=O)[C@@]1(O)C2=C(C[C@H](OC)[C@H]1O)OC1=CC=CC(O)=C1C2=O |
MNX internals
| InChI (mnx) | InChI=1/C16H16O8/c1-22-10-6-9-12(16(21,14(10)19)15(20)23-2)13(18)11-7(17)4-3-5-8(11)24-9/h3-5,10,14,17,19,21H,6H2,1-2H3/t10-,14+,16+/m0/s1 |
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| SMILES (mnx) | [CH3:1][O:22][C@H:10]1[CH2:6][C:9]2=[C:12]([C:13](=[O:18])[C:11]3=[C:7]([OH:17])[CH:4]=[CH:3][CH:5]=[C:8]3[O:24]2)[C@@:16]([C:15](=[O:20])[O:23][CH3:2])([OH:21])[C@@H:14]1[OH:19] |
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