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CHEBI:223291 - Calbistrin B
| Formula | C31H40O8 |
| Net Charge | 0 |
| Average Mass | 540.653 |
| Monoisotopic Mass | 540.27232 |
| SMILES | CC(=C/C=C/C(=O)O)/C=C/C=C(\C)[C@H](O)[C@H](C)C(=O)O[C@H]1C[C@H](C)C=C2C=C[C@@]3(C)O[C@@H](O)CC(=O)[C@]3(C)[C@H]21 |
| InChI | InChI=1S/C31H40O8/c1-18(10-8-12-25(33)34)9-7-11-20(3)28(36)21(4)29(37)38-23-16-19(2)15-22-13-14-30(5)31(6,27(22)23)24(32)17-26(35)39-30/h7-15,19,21,23,26-28,35-36H,16-17H2,1-6H3,(H,33,34)/b9-7+,12-8+,18-10-,20-11+/t19-,21+,23+,26-,27-,28+,30-,31-/m1/s1 |
| InChIKey | YKPRQPBIYQBKND-NZLBJVAFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Penicillium restrictum (ncbitaxon:69784) | - | PubMed (8436558) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Calbistrin B (CHEBI:223291) is a organic heterotricyclic compound (CHEBI:26979) |
| Calbistrin B (CHEBI:223291) is a organooxygen compound (CHEBI:36963) |