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Compounds

COMPOUND NPA000814

STRUCTURE
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PROPERTIES
NPAID NPA000814
CLUSTER ID 581
NODE ID 96
NAME BZR-cotoxin I
FORMULA C48H85N7O13
MOLECULAR WEIGHT (Da) 968.2440
ACCURATE MASS (Da) 967.6205
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Bipolaris
ORIGIN SPECIES zeicola
InChIKey NZTGVGORBGCOFL-UHFFFAOYSA-N
InChI InChI=1S/C48H85N7O13/c1-20-29(12)36-44(62)53(17)35(26(6)7)43(61)52(16)34(22-25(4)5)40(58)50-33(23-56)48(66)68-38(27(8)9)45(63)51(15)30(13)47(65)67-39(28(10)11)46(64)55(19)37(31(14)57)41(59)49-32(21-24(2)3)42(60)54(36)18/h24-39,56-57H,20-23H2,1-19H3,(H,49,59)(H,50,58)
SMILES CCC(C)C1C(=O)N(C(C(=O)N(C(C(=O)NC(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)NC(C(=O)N1C)CC(C)C)C(C)O)C)C(C)C)C)C)C(C)C)CO)CC(C)C)C)C(C)C)C
ORIGINAL ISOLATION REFERENCE
CITATION Ueda, Kazuo; Nakatsuka, Shin-ichi; Xiao, Jin-Zhong; Doke, Noriyuki Structure of BZR-cotoxin I produced by Bipolaris zeicola race 3, the cause of leaf spot disease in corn Tetrahedron Letters 1994 35 (38) 7033-7036.
DOI 10.1016/0040-4039(94)88218-5 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 Bipolaris MycoBank 33194
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