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CHEBI:223668 - Tricholomenyn E
| Formula | C36H36O12 |
| Net Charge | 0 |
| Average Mass | 660.672 |
| Monoisotopic Mass | 660.22068 |
| SMILES | C=C(C#CC1=C[C@@H](OC(C)=O)[C@H](O)[C@@H](OC(=O)/C(C)=C/CCC(=C)C#Cc2cc(OC(C)=O)cc(O)c2O)C1=O)CC/C=C(\C)C(=O)O |
| InChI | InChI=1S/C36H36O12/c1-20(9-7-11-22(3)35(43)44)14-16-27-18-30(47-25(6)38)33(42)34(32(27)41)48-36(45)23(4)12-8-10-21(2)13-15-26-17-28(46-24(5)37)19-29(39)31(26)40/h11-12,17-19,30,33-34,39-40,42H,1-2,7-10H2,3-6H3,(H,43,44)/b22-11+,23-12+/t30-,33+,34+/m1/s1 |
| InChIKey | KGBCLGUIYVEELO-JPXDOWQKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Tricholoma acerbum (ncbitaxon:181706) | - | DOI (10.1016/0040-4039(96)01329-9) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Tricholomenyn E (CHEBI:223668) has functional parent tetracarboxylic acid (CHEBI:35742) |
| Tricholomenyn E (CHEBI:223668) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (E)-8-[(3R,4S,5R)-3-acetyloxy-5-[(E)-8-(5-acetyloxy-2,3-dihydroxyphenyl)-2-methyl-6-methylideneoct-2-en-7-ynoyl]oxy-4-hydroxy-6-oxocyclohexen-1-yl]-2-methyl-6-methylideneoct-2-en-7-ynoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78441920 | ChemSpider |