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CHEBI:191772 - Pipercyclobutanamide B
| Formula | C36H40N2O6 |
| Net Charge | 0 |
| Average Mass | 596.724 |
| Monoisotopic Mass | 596.28864 |
| SMILES | O=C(/C=C\[C@@H]1[C@@H](/C=C/C=C/c2ccc3c(c2)OCO3)[C@H](C(=O)N2CCCCC2)[C@H]1c1ccc2c(c1)OCO2)N1CCCCC1 |
| InChI | InChI=1S/C36H40N2O6/c39-33(37-17-5-1-6-18-37)16-13-28-27(10-4-3-9-25-11-14-29-31(21-25)43-23-41-29)35(36(40)38-19-7-2-8-20-38)34(28)26-12-15-30-32(22-26)44-24-42-30/h3-4,9-16,21-22,27-28,34-35H,1-2,5-8,17-20,23-24H2/b9-3+,10-4+,16-13-/t27-,28-,34+,35+/m1/s1 |
| InChIKey | QFSZYBIYCZLMMS-FYHGELSASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ulmus parvifolia (ncbitaxon:63058) | |||
| bark (BTO:0001301) | MetaboLights (MTBLS4572) | ||
| seed (BTO:0001226) | MetaboLights (MTBLS4572) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pipercyclobutanamide B (CHEBI:191772) is a benzodioxoles (CHEBI:38298) |
| IUPAC Name |
|---|
| (Z)-3-[(1R,2S,3S,4R)-2-(1,3-benzodioxol-5-yl)-4-[(1E,3E)-4-(1,3-benzodioxol-5-yl)buta-1,3-dienyl]-3-(piperidine-1-carbonyl)cyclobutyl]-1-piperidin-1-ylprop-2-en-1-one |