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Compounds

COMPOUND NPA000142

STRUCTURE
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PROPERTIES
NPAID NPA000142
CLUSTER ID 120
NODE ID 114
NAME Phomadecalin B
FORMULA C17H22O5
MOLECULAR WEIGHT (Da) 306.3580
ACCURATE MASS (Da) 306.1467
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Phoma
ORIGIN SPECIES sp. NRRL 25697
InChIKey YSHGMEBFNCQBIY-GPJUBECRSA-N
InChI InChI=1S/C17H22O5/c1-9(8-21-11(3)18)17-14(20)7-12-5-6-13(19)10(2)16(12,4)15(17)22-17/h5-7,10,13-15,19-20H,1,8H2,2-4H3/t10-,13+,14+,15+,16+,17-/m0/s1
SMILES C[C@H]1[C@@H](C=CC2=C[C@H]([C@]3([C@@H]([C@]12C)O3)C(=C)COC(=O)C)O)O
ORIGINAL ISOLATION REFERENCE
CITATION Che, Yongsheng; Gloer, James B.; Wicklow, Donald T. Phomadecalins A-D and phomapentenone A: New bioactive metabolites from Phoma sp. NRRL 25697, a fungal colonist of Hypoxylon stromata Journal of Natural Products 2002 65 (3) 399-402.
DOI 10.1021/np010519o PMID 11908990
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Dothideomycetes MycoBank 147541
Order Pleosporales MycoBank 92860
Genus Phoma MycoBank 37463
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