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| Formula | C25H24N4O5 |
| Net Charge | 0 |
| Average Mass | 460.490 |
| Monoisotopic Mass | 460.17467 |
| SMILES | [H]OC(=O)c1c(O[H])c([H])c2oc([H])c([C@@]3([H])N([H])N([H])N(C([H])([H])C([H])([H])C([H])([H])C(=O)N([H])c4c([H])c([H])c([H])c5c([H])c([H])c([H])c([H])c45)C3([H])[H])c2c1[H] |
| InChI | InChI=1S/C25H24N4O5/c30-22-12-23-17(11-18(22)25(32)33)19(14-34-23)21-13-29(28-27-21)10-4-9-24(31)26-20-8-3-6-15-5-1-2-7-16(15)20/h1-3,5-8,11-12,14,21,27-28,30H,4,9-10,13H2,(H,26,31)(H,32,33)/t21-/m0/s1 |
| InChIKey | KWXBSQWOCREJEL-NRFANRHFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-HYDROXY-3-{(4R)-1-[4-(1-NAPHTHYLAMINO)-4-OXOBUTYL]-1,2,3-TRIAZOLIDIN-4-YL}-1-BENZOFURAN-5-CARBOXYLIC ACID (CHEBI:49419) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 6-HYDROXY-3-{(4R)-1-[4-(1-NAPHTHYLAMINO)-4-OXOBUTYL]-1,2,3-TRIAZOLIDIN-4-YL}-1-BENZOFURAN-5-CARBOXYLIC ACID | PDBeChem |
| 6-hydroxy-3-{(4R)-1-[4-(naphthalen-1-ylamino)-4-oxobutyl]-1,2,3-triazolidin-4-yl}-1-benzofuran-5-carboxylic acid | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 561 | PDBeChem |