Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000814
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 | - |
