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CHEBI:42335 - S)-2-(5(((1,2-DIHYDRO-3-METHYL-1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-OXO-2-ISOINDOLINYL)GLUTARIC ACID
| Formula | C27H24N4O6 |
| Net Charge | 0 |
| Average Mass | 500.511 |
| Monoisotopic Mass | 500.16958 |
| SMILES | [H]OC(=O)C([H])([H])C([H])([H])[C@@]([H])(C(=O)O[H])N1C(=O)c2c([H])c([H])c(N([H])C([H])([H])c3c([H])c([H])c4c([H])c([H])c5nc(C([H])([H])[H])n([H])c(=O)c5c4c3[H])c([H])c2C1([H])[H] |
| InChI | InChI=1S/C27H24N4O6/c1-14-29-21-7-4-16-3-2-15(10-20(16)24(21)25(34)30-14)12-28-18-5-6-19-17(11-18)13-31(26(19)35)22(27(36)37)8-9-23(32)33/h2-7,10-11,22,28H,8-9,12-13H2,1H3,(H,32,33)(H,36,37)(H,29,30,34)/t22-/m0/s1 |
| InChIKey | BRVFNEZMTRVUGW-QFIPXVFZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| S)-2-(5(((1,2-DIHYDRO-3-METHYL-1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-OXO-2-ISOINDOLINYL)GLUTARIC ACID (CHEBI:42335) is a indolyl carboxylic acid (CHEBI:46867) |
| Synonyms | Source |
|---|---|
| (2S)-2-(5-{[(3-methyl-1-oxo-1,2-dihydrobenzo[f]quinazolin-9-yl)methyl]amino}-1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanedioic acid | PDBeChem |
| S)-2-(5(((1,2-DIHYDRO-3-METHYL-1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-OXO-2-ISOINDOLINYL)GLUTARIC ACID | PDBeChem |
| 1843U89 | KEGG COMPOUND |