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Compounds

COMPOUND NPA019296

STRUCTURE
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PROPERTIES
NPAID NPA019296
CLUSTER ID 863
NODE ID 747
NAME Arnamial
FORMULA C24H29ClO6
MOLECULAR WEIGHT (Da) 448.9430
ACCURATE MASS (Da) 448.1653
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Armillaria
ORIGIN SPECIES mellea
InChIKey KWJJPEZBNLGOFB-RNNQDMPLSA-N
InChI InChI=1S/C24H29ClO6/c1-11-18(15(27)6-16(30-5)20(11)25)22(29)31-17-9-24(4)14-8-23(2,3)7-12(14)21(28)13(10-26)19(17)24/h6,10,12,14,17,21,27-28H,7-9H2,1-5H3/t12-,14+,17-,21+,24-/m1/s1
SMILES CC1=C(C(=CC(=C1Cl)OC)O)C(=O)O[C@@H]2C[C@]3(C2=C([C@H]([C@H]4[C@@H]3CC(C4)(C)C)O)C=O)C
ORIGINAL ISOLATION REFERENCE
CITATION Misiek, Mathias; Williams, Jessica; Schmich, Kathrin; Huettel, Wolfgang; Merfort, Irmgard; Salomon, Christine E.; Aldrich, Courtney C.; Hoffmeister, Dirk Structure and cytotoxicity of arnamial and related fungal sesquiterpene aryl esters Journal of Natural Products 2009 72 (10) 1888-1891.
DOI 10.1021/np900314p PMID 19795841
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Basidiomycota MycoBank 5204
Class Agaricomycetes MycoBank 155619
Order Agaricales MycoBank 5338
Family Physalacriaceae MycoBank 862241
Genus Armillaria MycoBank 47424
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