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CHEBI:218232 - Albicidin
| Formula | C44H38N6O12 |
| Net Charge | 0 |
| Average Mass | 842.818 |
| Monoisotopic Mass | 842.25477 |
| SMILES | COc1c(NC(=O)c2ccc(NC(=O)c3ccc(NC(=O)[C@H](CC#N)NC(=O)c4ccc(NC(=O)/C(C)=C/c5ccc(O)cc5)cc4)cc3)c(OC)c2O)ccc(C(=O)O)c1O |
| InChI | InChI=1S/C44H38N6O12/c1-23(22-24-4-14-29(51)15-5-24)39(54)46-27-10-6-26(7-11-27)41(56)50-34(20-21-45)43(58)47-28-12-8-25(9-13-28)40(55)48-32-18-16-30(35(52)37(32)61-2)42(57)49-33-19-17-31(44(59)60)36(53)38(33)62-3/h4-19,22,34,51-53H,20H2,1-3H3,(H,46,54)(H,47,58)(H,48,55)(H,49,57)(H,50,56)(H,59,60)/b23-22+/t34-/m0/s1 |
| InChIKey | NZSWNNDHPOTJNH-VEJILBAHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Xanthomonas albilineans (ncbitaxon:29447) | - | PubMed (25599532) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Albicidin (CHEBI:218232) is a benzamides (CHEBI:22702) |
| IUPAC Name |
|---|
| 4-[[4-[[4-[[(2S)-3-cyano-2-[[4-[[(E)-3-(4-hydroxyphenyl)-2-methylprop-2-enoyl]amino]benzoyl]amino]propanoyl]amino]benzoyl]amino]-2-hydroxy-3-methoxybenzoyl]amino]-2-hydroxy-3-methoxybenzoic acid |