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6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoate
MNXM35131 is deprecated and here replaced by MNXM1369204
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM1369204 |
 |
| reference | chebi:36537 |
| formula | C12H10NO4 |
| global charge | -1 |
| mol weight | 232.215 |
| InChIKey | AFPIGEHQFVBSJA-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H11NO4/c13-9-5-2-1-4-8(9)10(14)6-3-7-11(15)12(16)17/h1-7,15H,13H2,(H,16,17)/p-1 |
| SMILES | NC1=C(C(=O)C=CC=C(O)C(=O)[O-])C=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C12H11NO4/c13-9-5-2-1-4-8(9)10(14)6-3-7-11(15)12(16)17/h1-7,15H,13H2,(H,16,17)/b6-3?,11-7? |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:5]=[C:9]([NH2:13])[C:8]([C:10]([CH:6]=[CH:3][CH:7]=[C:11]([C:12](=[O:16])[OH:17])[OH:15])=[O:14])=[CH:4]1 |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
CHEBI:36537 chebi:36537 AFPIGEHQFVBSJA-UHFFFAOYSA-M
| 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoate 2-hydroxy-6-oxo-(2'-aminophenyl)-hexa-2,4-dienoate 6-(2-aminophenyl)-6-oxo-2-hydroxy-2,4-hexadienoic acid(1-)
|
CHEBI:197289 chebi:197289 AFPIGEHQFVBSJA-UHFFFAOYSA-N
| 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid 2-hydroxy-6-oxo-(2'-aminophenyl)-hexa-2,4-dienoic acid
|
chebi:1133 chebi:19616
| secondary/obsolete/fantasy identifier
|