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Compounds

COMPOUND NPA003702

STRUCTURE
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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.
DOI 10.1021/np900442y PMID 19848435
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Lecanoromycetes MycoBank 147547
Order Caliciales MycoBank 1302181
Family Caliciaceae MycoBank 39937
Genus Pyxine MycoBank 205635
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