| Properties | Image |
| MNX_ID | MNXM29562 |
 |
| reference | lipidmapsM:LMPK12050443 |
| formula | C16H12O7 |
| global charge | 0 |
| mol weight | 316.265 |
| InChIKey | NHKRWDZHHWTCAH-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H12O7/c1-22-16-14(21)13(20)12(19)10-11(18)9(6-23-15(10)16)7-2-4-8(17)5-3-7/h2-6,17,19-21H,1H3 |
| SMILES | COC1=C2OC=C(C3=CC=C(O)C=C3)C(=O)C2=C(O)C(O)=C1O |
MNX internals
| InChI (mnx) | InChI=1/C16H12O7/c1-22-16-14(21)13(20)12(19)10-11(18)9(6-23-15(10)16)7-2-4-8(17)5-3-7/h2-6,17,19-21H,1H3 |
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| SMILES (mnx) | [CH3:1][O:22][C:16]1=[C:14]([OH:21])[C:13]([OH:20])=[C:12]([OH:19])[C:10]2=[C:15]1[O:23][CH:6]=[C:9]([C:7]1=[CH:3][CH:5]=[C:8]([OH:17])[CH:4]=[CH:2]1)[C:11]2=[O:18] |
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