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(2Z,2E)-2-hydroxy-6-oxo-6-(2,3-dihydroxyphenyl)-hexa-2,4-dienoate
MNXM480284 is deprecated and here replaced by MNXM1369705
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM1369705 |
 |
| reference | metacycM:CPD-14165 |
| formula | C12H9O6 |
| global charge | -1 |
| mol weight | 249.198 |
| InChIKey | JFQLMGJVLFOTFW-QXYPORFMSA-M |
| InChI | InChI=1S/C12H10O6/c13-8(4-2-6-10(15)12(17)18)7-3-1-5-9(14)11(7)16/h1-6,14-16H,(H,17,18)/p-1/b4-2+,10-6- |
| SMILES | O=C(/C=C/C=C(\O)C(=O)[O-])C1=C(O)C(O)=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C12H10O6/c13-8(4-2-6-10(15)12(17)18)7-3-1-5-9(14)11(7)16/h1-6,14-16H,(H,17,18)/b4-2+,10-6- |
 |
| SMILES (mnx) | [CH:1]1=[CH:3][C:7]([C:8](/[CH:4]=[CH:2]/[CH:6]=[C:10](/[C:12](=[O:17])[OH:18])[OH:15])=[O:13])=[C:11]([OH:16])[C:9]([OH:14])=[CH:5]1 |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
0 |
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