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CHEBI:205720 - Leupyrrin D
| Formula | C40H54N2O10 |
| Net Charge | 0 |
| Average Mass | 722.876 |
| Monoisotopic Mass | 722.37785 |
| SMILES | C/C(CCCO)=C1/COC(CC(C)C)/C1=C\C1N=C2OC1COC(=O)/C(CC(C)C)=C/C(=O)OC1C(OC(=O)C1(C)CO)/C(C)=C/Cc1ccc2n1 |
| InChI | InChI=1S/C40H54N2O10/c1-22(2)15-26-17-34(45)51-36-35(52-39(47)40(36,7)21-44)25(6)10-11-27-12-13-30(41-27)37-42-31(33(50-37)20-49-38(26)46)18-28-29(24(5)9-8-14-43)19-48-32(28)16-23(3)4/h10,12-13,17-18,22-23,31-33,35-36,41,43-44H,8-9,11,14-16,19-21H2,1-7H3/b25-10+,26-17+,28-18-,29-24+ |
| InChIKey | ODGIZTYDFSNPEL-BVVGETRBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sorangium (ncbitaxon:39643) | - | PubMed (14510597) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Leupyrrin D (CHEBI:205720) is a macrolide (CHEBI:25106) |
| IUPAC Name |
|---|
| (7E,16E)-12-(hydroxymethyl)-22-[(Z)-[(4Z)-4-(5-hydroxypentan-2-ylidene)-2-(2-methylpropyl)oxolan-3-ylidene]methyl]-8,12-dimethyl-17-(2-methylpropyl)-10,14,19,24-tetraoxa-23,25-diazatetracyclo[19.2.1.12,5.09,13]pentacosa-1(23),2,4,7,16-pentaene-11,15,18-trione |
| Manual Xrefs | Databases |
|---|---|
| 78444119 | ChemSpider |