Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA003702
PROPERTIES
NPAID | NPA003702 |
---|---|
CLUSTER ID | 274 |
NODE ID | 163 |
NAME | Fern-9(11)-en-3,19-dione |
FORMULA | C30H46O2 |
MOLECULAR WEIGHT (Da) | 438.6960 |
ACCURATE MASS (Da) | 438.3498 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Pyxine |
ORIGIN SPECIES | berteriana |
InChIKey | MOKIXNUQEWEPPU-IJKLQHKJSA-N |
InChI | InChI=1S/C30H46O2/c1-18(2)21-17-22(31)25-28(21,6)15-16-29(7)20-9-10-23-26(3,4)24(32)12-13-27(23,5)19(20)11-14-30(25,29)8/h11,18,20-21,23,25H,9-10,12-17H2,1-8H3/t20-,21+,23-,25+,27+,28+,29+,30-/m0/s1 |
SMILES | CC(C)[C@H]1CC(=O)[C@@H]2[C@@]1(CC[C@]3([C@]2(CC=C4[C@@H]3CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Maier, Marta S.; Rosso, María L.; Fazio, Alejandra T.; Adler, Mónica T.; Bertoni, María D. Fernene Triterpenoids from the Lichen Pyxine berteriana Journal of Natural Products 2009 72 (10) 1902-1904. | ||
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DOI | 10.1021/np900442y | PMID | 19848435 |