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Compounds

COMPOUND NPA003112

STRUCTURE
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PROPERTIES
NPAID NPA003112
CLUSTER ID 490
NODE ID 440
NAME AAL-Toxin
FORMULA C25H47NO10
MOLECULAR WEIGHT (Da) 521.6480
ACCURATE MASS (Da) 521.3200
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Alternaria
ORIGIN SPECIES alternata
InChIKey DOFQASYPBACFKP-UMSUPTIDSA-N
InChI InChI=1S/C25H47NO10/c1-4-16(3)24(36-23(33)12-17(25(34)35)11-22(31)32)21(30)10-15(2)8-6-5-7-9-19(28)20(29)13-18(27)14-26/h15-21,24,27-30H,4-14,26H2,1-3H3,(H,31,32)(H,34,35)/t15?,16?,17?,18-,19+,20-,21?,24?/m0/s1
SMILES CCC(C)C(C(CC(C)CCCCC[C@H]([C@H](C[C@@H](CN)O)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O
ORIGINAL ISOLATION REFERENCE
CITATION Abbas, Hamed K.; Vesonder, R.F. Isolation and purification of aal-toxin from Alternaria alternata grown on rice Toxicon 1993 31 (3) 355-358.
DOI 10.1016/0041-0101(93)90153-a PMID -
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
Family Pleosporaceae MycoBank 28556
Genus Alternaria MycoBank 5598
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