EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H37N5O9 |
| Net Charge | 0 |
| Average Mass | 527.575 |
| Monoisotopic Mass | 527.25913 |
| SMILES | [H]OC([H])([H])[C@@]1([H])O[C@]([H])(Oc2c([H])c(C(=O)N([H])C([H])([H])C([H])([H])C([H])([H])N3C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])C([H])([H])N([H])[H])C([H])([H])C3([H])[H])c([H])c([N+](=O)[O-])c2[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]1([H])O[H] |
| InChI | InChI=1S/C23H37N5O9/c24-3-1-5-26-7-9-27(10-8-26)6-2-4-25-22(33)15-11-16(28(34)35)13-17(12-15)36-23-21(32)20(31)19(30)18(14-29)37-23/h11-13,18-21,23,29-32H,1-10,14,24H2,(H,25,33)/t18-,19+,20+,21-,23+/m1/s1 |
| InChIKey | UEIGEWJJVQHIAX-MKQKURRLSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-{3-[4-(3-aminopropyl)piperazin-1-yl]propyl}-3-nitro-5-(α-D-galactopyranosyl)benzamide (CHEBI:43535) is a N-{3-[4-(3-aminopropyl)piperazin-1-yl]propyl}-3-nitro-5-(D-galactopyranosyl)benzamide (CHEBI:46943) |
| Synonyms | Source |
|---|---|
| N-{3-[4-(3-AMINO-PROPYL)-PIPERAZIN-1-YL]-PROPYL}-3-NITRO-5-(GALACTOPYRANOSYL)-ALPHA-BENZAMIDE | PDBeChem |
| N-{3-[4-(3-aminopropyl)piperazin-1-yl]propyl}-3-(alpha-D-galactopyranosyloxy)-5-nitrobenzamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| J15 | PDBeChem |