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CHEBI:200476 - Terretonin A
| Formula | C26H32O8 |
| Net Charge | 0 |
| Average Mass | 472.534 |
| Monoisotopic Mass | 472.20972 |
| SMILES | C=C1C[C@H]2[C@@](C)(C(=O)C(O)=C3C(C)(C)C(=O)CC[C@@]32C)[C@@H]2C(=O)O[C@@](C)(C(=O)OC)C(=O)[C@@]12C |
| InChI | InChI=1S/C26H32O8/c1-12-11-13-23(4)10-9-14(27)22(2,3)16(23)15(28)18(29)25(13,6)17-19(30)34-26(7,21(32)33-8)20(31)24(12,17)5/h13,17,28H,1,9-11H2,2-8H3/t13-,17-,23-,24+,25-,26-/m1/s1 |
| InChIKey | GTEJJXOFLPCZGJ-DOFPOEDPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus terreus (ncbitaxon:33178) | - | PubMed (16124769) | |
| Aspergillus (ncbitaxon:5052) | - | DOI (10.1016/j.phytol.2019.05.017) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Terretonin A (CHEBI:200476) is a steroid lactone (CHEBI:26766) |
| IUPAC Names |
|---|
| methyl (2R,4aS,4bR,10aR,10bR,12aR)-6-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-9,10,10b,11-tetrahydro-4aH-naphtho[1,2-h]isochromene-2-carboxylate |
| methyl (2S,4aR,4bS,10aS,10bS,12aS)-6-hydroxy-2,4b,7,7,10a,12a-hexamethyl-12-methylidene-1,4,5,8-tetraoxo-9,10,10b,11-tetrahydro-4aH-naphtho[1,2-h]isochromene-2-carboxylate |