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CHEBI:204239 - Lobarialide A
| Formula | C30H44O4 |
| Net Charge | 0 |
| Average Mass | 468.678 |
| Monoisotopic Mass | 468.32396 |
| SMILES | CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC[C@H]4[C@]5(C)C(=O)O[C@@H]6C[C@@]4(C3=CC[C@@]21C)[C@@H](O)O[C@@H]65 |
| InChI | InChI=1S/C30H44O4/c1-16(2)17-7-9-21-26(17,3)13-14-27(4)18-8-10-22-29(6)23-20(33-24(29)31)15-30(22,25(32)34-23)19(18)11-12-28(21,27)5/h11,16-18,20-23,25,32H,7-10,12-15H2,1-6H3/t17-,18+,20-,21-,22+,23+,25+,26-,27-,28+,29+,30+/m1/s1 |
| InChIKey | QZOSKMSFHAYNQU-IJBAJRCLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Lobaria kurokawae (ncbitaxon:376185) | - | PubMed (19479840) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Lobarialide A (CHEBI:204239) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (1R,5S,6R,9R,10R,13R,14R,17R,18S,21R,22R,24S)-24-hydroxy-5,10,13,18-tetramethyl-9-propan-2-yl-20,23-dioxaheptacyclo[19.3.1.01,17.02,14.05,13.06,10.018,22]pentacos-2-en-19-one |
| Manual Xrefs | Databases |
|---|---|
| 28286355 | ChemSpider |