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CHEBI:227403 - Colobetaolactone E
| Formula | C32H42O6 |
| Net Charge | 0 |
| Average Mass | 522.682 |
| Monoisotopic Mass | 522.29814 |
| SMILES | CC(=O)O[C@@H]1C[C@H]([C@H](C)C2CC=C(C)C(=O)O2)[C@@]2(C)CCC3=C(CC[C@@H]4C(=C3)C=CC(=O)OC4(C)C)[C@]12C |
| InChI | InChI=1S/C32H42O6/c1-18-8-12-26(37-29(18)35)19(2)25-17-27(36-20(3)33)32(7)24-11-10-23-21(9-13-28(34)38-30(23,4)5)16-22(24)14-15-31(25,32)6/h8-9,13,16,19,23,25-27H,10-12,14-15,17H2,1-7H3/t19-,23+,25+,26?,27+,31+,32+/m0/s1 |
| InChIKey | BKBKEBSSMOWKJE-MEIOAICRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma colossus (ncbitaxon:36070) | - | DOI (10.1021/np000437k) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Colobetaolactone E (CHEBI:227403) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| [(9R,13R,14R,16R,17R)-8,8,13,17-tetramethyl-16-[(1S)-1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-6-oxo-7-oxatetracyclo[10.7.0.03,9.013,17]nonadeca-1(12),2,4-trien-14-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 8383807 | ChemSpider |