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CHEBI:198521 - Speradine B
| Formula | C16H18N2O3 |
| Net Charge | 0 |
| Average Mass | 286.331 |
| Monoisotopic Mass | 286.13174 |
| SMILES | CN1C(=O)C2(O)c3c(cccc31)C[C@@H]1[C@H]2C(=O)NC1(C)C |
| InChI | InChI=1S/C16H18N2O3/c1-15(2)9-7-8-5-4-6-10-11(8)16(21,14(20)18(10)3)12(9)13(19)17-15/h4-6,9,12,21H,7H2,1-3H3,(H,17,19)/t9-,12+,16?/m1/s1 |
| InChIKey | NJNVLWKPNCWDDC-BVZBXKMVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus oryzae (ncbitaxon:5062) | - | DOI (10.3987/com-14-13004) | |
| Penicillium dipodomyicola (ncbitaxon:254876) | - | DOI (10.1007/s10600-015-1395-4) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Speradine B (CHEBI:198521) is a isoindoles (CHEBI:24897) |
| IUPAC Names |
|---|
| (2R,6R)-1-hydroxy-5,5,13-trimethyl-4,13-diazatetracyclo[6.6.1.02,6.012,15]pentadeca-8(15),9,11-triene-3,14-dione |
| (1R)-5-acetyl-3,4,5-trihydroxy-8,8-dimethyl-19-oxa-7,16-diazahexacyclo[9.6.1.11,4.02,9.03,7.015,18]nonadeca-11(18),12,14-triene-6,17-dione |