EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H21NO6 |
| Net Charge | 0 |
| Average Mass | 335.356 |
| Monoisotopic Mass | 335.13689 |
| SMILES | CCC(=O)Nc1cc(O)cc2c1O[C@H](C=C(C)C(=O)O)[C@@H](O)CC2 |
| InChI | InChI=1S/C17H21NO6/c1-3-15(21)18-12-8-11(19)7-10-4-5-13(20)14(24-16(10)12)6-9(2)17(22)23/h6-8,13-14,19-20H,3-5H2,1-2H3,(H,18,21)(H,22,23)/t13-,14+/m0/s1 |
| InChIKey | KOLISZHOJXSQBZ-UONOGXRCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Micromonosporaspecies (ncbitaxon:1876) | - | PubMed (29412682) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Microansamycin H (CHEBI:216926) is a oxacycle (CHEBI:38104) |
| IUPAC Name |
|---|
| 3-[(2R,3S)-3,7-dihydroxy-9-(propanoylamino)-2,3,4,5-tetrahydro-1-benzoxepin-2-yl]-2-methylprop-2-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78439354 | ChemSpider |