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CHEBI:217937 - Terretonin G
| Formula | C27H38O9 |
| Net Charge | 0 |
| Average Mass | 506.592 |
| Monoisotopic Mass | 506.25158 |
| SMILES | C=C1C[C@H]2[C@]3(C)CCC(=O)C(C)(C)[C@H]3C(=O)[C@@H](O)[C@]2(C)[C@@H](C(=O)OC)[C@]1(C)C(=O)[C@](C)(O)C(=O)OC |
| InChI | InChI=1S/C27H38O9/c1-13-12-14-24(4)11-10-15(28)23(2,3)17(24)16(29)19(30)26(14,6)18(20(31)35-8)25(13,5)21(32)27(7,34)22(33)36-9/h14,17-19,30,34H,1,10-12H2,2-9H3/t14-,17+,18-,19+,24-,25+,26-,27-/m0/s1 |
| InChIKey | QKXFADNZXOBAQQ-DIEBFMLZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus (ncbitaxon:5052) | |||
| - | DOI (10.1016/j.phytol.2019.05.017) | ||
| - | PubMed (24802208) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Terretonin G (CHEBI:217937) is a oxo steroid (CHEBI:35789) |
| IUPAC Names |
|---|
| methyl (1R,2S,4aS,4bS,8aS,10S,10aS)-10-hydroxy-2-[(2S)-2-hydroxy-3-methoxy-2-methyl-3-oxopropanoyl]-2,4b,8,8,10a-pentamethyl-3-methylidene-7,9-dioxo-4,4a,5,6,8a,10-hexahydro-1H-phenanthrene-1-carboxylate |
| methyl (1S,2R,4aR,4bR,8aR,10R,10aR)-10-hydroxy-2-(2-hydroxy-3-methoxy-2-methyl-3-oxopropanoyl)-2,4b,8,8,10a-pentamethyl-3-methylidene-7,9-dioxo-4,4a,5,6,8a,10-hexahydro-1H-phenanthrene-1-carboxylate |