| Properties | Image |
| MNX_ID | MNXM27398 |
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| reference | lipidmapsM:LMPK12112865 |
| formula | C16H12O7 |
| global charge | 0 |
| mol weight | 316.265 |
| InChIKey | YLRSIAJFRWNBHO-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H12O7/c1-22-10-6-9-11(13(19)12(10)18)14(20)15(21)16(23-9)7-2-4-8(17)5-3-7/h2-6,17-19,21H,1H3 |
| SMILES | COC1=CC2=C(C(=O)C(O)=C(C3=CC=C(O)C=C3)O2)C(O)=C1O |
MNX internals
| InChI (mnx) | InChI=1/C16H12O7/c1-22-10-6-9-11(13(19)12(10)18)14(20)15(21)16(23-9)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:10]1=[C:12]([OH:18])[C:13]([OH:19])=[C:11]2[C:9](=[CH:6]1)[O:23][C:16]([C:7]1=[CH:3][CH:5]=[C:8]([OH:17])[CH:4]=[CH:2]1)=[C:15]([OH:21])[C:14]2=[O:20] |
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