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CHEBI:202209 - 18-Deoxy-19,20-epoxycytochalasin R
| Formula | C30H37NO7 |
| Net Charge | 0 |
| Average Mass | 523.626 |
| Monoisotopic Mass | 523.25700 |
| SMILES | CC(=O)O[C@@H]1[C@@H]2O[C@H]2[C@H](C)C(=O)[C@@H](C)C[C@@H]2OC2C2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H](Cc4ccccc4)NC(=O)[C@@]231 |
| InChI | InChI=1S/C30H37NO7/c1-13-11-19-24(36-19)21-26-29(5,38-26)15(3)20-18(12-17-9-7-6-8-10-17)31-28(34)30(20,21)27(35-16(4)32)25-23(37-25)14(2)22(13)33/h6-10,13-15,18-21,23-27H,11-12H2,1-5H3,(H,31,34)/t13-,14+,15-,18-,19-,20-,21?,23-,24?,25+,26-,27+,29+,30+/m0/s1 |
| InChIKey | CNGSBKRXKAQYGK-RCVCKCMISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Xylaria hypoxylon (ncbitaxon:37992) | - | DOI (10.1016/s0040-4020(97)00305-0) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 18-Deoxy-19,20-epoxycytochalasin R (CHEBI:202209) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| [(1R,2S,3R,5S,6S,8S,10S,14S,16R,17S,18R,19S)-19-benzyl-6,8,16,17-tetramethyl-7,21-dioxo-4,11,15-trioxa-20-azahexacyclo[11.8.0.01,18.03,5.010,12.014,16]henicosan-2-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 78441958 | ChemSpider |