EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C35H48N2O5 |
| Net Charge | 0 |
| Average Mass | 576.778 |
| Monoisotopic Mass | 576.35632 |
| SMILES | [H][C@]1([C@H](C)N(C)C)[C@H](OC(C)=O)C[C@]2(C)[C@]1(C)CC=C1C[C@]3(O)C=C[C@H](NC(=O)c4ccccc4)[C@@]4(C)CO[C@@]([H])(C[C@]12[H])[C@]34[H] |
| InChI | InChI=1S/C35H48N2O5/c1-21(37(6)7)29-27(42-22(2)38)19-34(5)25-17-26-30-32(3,20-41-26)28(36-31(39)23-11-9-8-10-12-23)14-16-35(30,40)18-24(25)13-15-33(29,34)4/h8-14,16,21,25-30,40H,15,17-20H2,1-7H3,(H,36,39)/t21-,25+,26-,27+,28-,29-,30-,32+,33+,34-,35+/m0/s1 |
| InChIKey | VCPJZJYGJJULKC-RRWISKKNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Buxus natalensis (IPNI:128681-1) | bark (BTO:0001301) | PubMed (20954721) | MeOH extract of pulverized bark |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (+)-buxafuranamide (CHEBI:70426) has role metabolite (CHEBI:25212) |
| (+)-buxafuranamide (CHEBI:70426) is a sesquiterpenoid (CHEBI:26658) |
| Manual Xrefs | Databases |
|---|---|
| 0123871272 | ChemIDplus |
| Citations |
|---|