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CHEBI:220339 - Theopederin D
| Formula | C26H41NO10 |
| Net Charge | 0 |
| Average Mass | 527.611 |
| Monoisotopic Mass | 527.27305 |
| SMILES | C=C1C[C@](OC)([C@@H](O)C(=O)N[C@H]2OCO[C@H]3[C@@H]2O[C@H](C[C@H]2CCC(=O)O2)C(C)(C)[C@@H]3OC)O[C@H](C)[C@@H]1C |
| InChI | InChI=1S/C26H41NO10/c1-13-11-26(32-7,37-15(3)14(13)2)21(29)23(30)27-24-20-19(33-12-34-24)22(31-6)25(4,5)17(36-20)10-16-8-9-18(28)35-16/h14-17,19-22,24,29H,1,8-12H2,2-7H3,(H,27,30)/t14-,15-,16-,17-,19+,20+,21+,22-,24+,26-/m1/s1 |
| InChIKey | QLDOXRUFJHMOHG-NSRFADATSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Candidatus Entotheonella factor (ncbitaxon:1429438) | - | PubMed (24476823) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Theopederin D (CHEBI:220339) is a organic heterobicyclic compound (CHEBI:27171) |
| Theopederin D (CHEBI:220339) is a oxacycle (CHEBI:38104) |
| IUPAC Name |
|---|
| (2R)-N-[(4S,4aS,6R,8S,8aR)-8-methoxy-7,7-dimethyl-6-[[(2R)-5-oxooxolan-2-yl]methyl]-4a,6,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-4-yl]-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetamide |