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CHEBI:227509 - Kadhenrischinin D
| Formula | C30H40O6 |
| Net Charge | 0 |
| Average Mass | 496.644 |
| Monoisotopic Mass | 496.28249 |
| SMILES | CC1(C)OC(=O)C=CC2=CC3=C(CC[C@H]21)[C@]1(C)CCC([C@@H]2C[C@@H]4C[C@H]2OC(=O)[C@]4(C)O)[C@@]1(C)C[C@H]3O |
| InChI | InChI=1S/C30H40O6/c1-27(2)20-7-8-21-18(12-16(20)6-9-25(32)36-27)23(31)15-29(4)22(10-11-28(21,29)3)19-13-17-14-24(19)35-26(33)30(17,5)34/h6,9,12,17,19-20,22-24,31,34H,7-8,10-11,13-15H2,1-5H3/t17-,19+,20-,22?,23-,24-,28+,29-,30-/m1/s1 |
| InChIKey | WVARVCUKYGNGBL-GTFNCBLCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Penicillium (ncbitaxon:5073) | - | PubMed (30476897) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Kadhenrischinin D (CHEBI:227509) is a lactone (CHEBI:25000) |
| IUPAC Name |
|---|
| (9R,13R,17R,19R)-19-hydroxy-16-[(1R,4R,5R,7S)-4-hydroxy-4-methyl-3-oxo-2-oxabicyclo[3.2.1]octan-7-yl]-8,8,13,17-tetramethyl-7-oxatetracyclo[10.7.0.03,9.013,17]nonadeca-1(12),2,4-trien-6-one |