EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H22N4O3 |
| Net Charge | 0 |
| Average Mass | 390.443 |
| Monoisotopic Mass | 390.16919 |
| SMILES | [H]/C(C1=N/C(=N/Nc2ccccc2)C(CCC(=O)O)=C1C)=C1\C(C=C)=C(C)C(=O)N1[H] |
| InChI | InChI=1S/C22H22N4O3/c1-4-16-14(3)22(29)24-19(16)12-18-13(2)17(10-11-20(27)28)21(23-18)26-25-15-8-6-5-7-9-15/h4-9,12,25H,1,10-11H2,2-3H3,(H,24,29)(H,27,28)/b19-12-,26-21+ |
| InChIKey | XFLUBKGHMOSONT-MITDQAQDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[(2E)-4-methyl-5-[(Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-(phenylhydrazono)-2H-pyrrol-3-yl]propanoic acid (CHEBI:142134) is a dipyrrins (CHEBI:36749) |
| 3-[(2E)-4-methyl-5-[(Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-(phenylhydrazono)-2H-pyrrol-3-yl]propanoic acid (CHEBI:142134) is a hydrazone (CHEBI:38532) |
| 3-[(2E)-4-methyl-5-[(Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-(phenylhydrazono)-2H-pyrrol-3-yl]propanoic acid (CHEBI:142134) is tautomer of 8-(2-carboxyethyl)-2,7-dimethyl-3-vinyl-9-(phenyldiazenyl)dipyrrin-1(10H)-one (CHEBI:142128) |
| Incoming Relation(s) |
| 8-(2-carboxyethyl)-2,7-dimethyl-3-vinyl-9-(phenyldiazenyl)dipyrrin-1(10H)-one (CHEBI:142128) is tautomer of 3-[(2E)-4-methyl-5-[(Z)-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-(phenylhydrazono)-2H-pyrrol-3-yl]propanoic acid (CHEBI:142134) |
| IUPAC Name |
|---|
| 3-[(2E)-5-[(Z)-(3-ethenyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2-(2-phenylhydrazinylidene)-2H-pyrrol-3-yl]propanoic acid |
| Synonym | Source |
|---|---|
| aniline azopigment (phenylhydrazone form) | ChEBI |
| Citations |
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