EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C26H39ClO9 |
| Net Charge | 0 |
| Average Mass | 531.042 |
| Monoisotopic Mass | 530.22826 |
| SMILES | C[C@]1(C(O)CCl)CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC(=O)[C@]3(C)CO[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@@H](O)[C@@H]2O)C1 |
| InChI | InChI=1S/C26H39ClO9/c1-24(17(29)11-27)8-6-14-13(10-24)4-5-15-25(14,2)9-7-16(28)26(15,3)12-35-23-20(32)18(30)19(31)21(36-23)22(33)34/h4,14-15,17-21,23,29-32H,5-12H2,1-3H3,(H,33,34)/t14-,15+,17?,18+,19-,20-,21-,23+,24-,25+,26+/m0/s1 |
| InChIKey | LHIBDHTXDXNPDR-ODVXWTEXSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sagenomella striatispora (ncbitaxon:743106) | - | PubMed (21922899) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Virescenoside Z5 (CHEBI:203850) is a diterpene glycoside (CHEBI:71939) |
| IUPAC Name |
|---|
| (2S,3S,4R,5S,6R)-6-[[(1S,4aR,4bS,7S,10aR)-7-(2-chloro-1-hydroxyethyl)-1,4a,7-trimethyl-2-oxo-3,4,4b,5,6,8,10,10a-octahydrophenanthren-1-yl]methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 29212278 | ChemSpider |