Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013699
PROPERTIES
| NPAID | NPA013699 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | BZR-cotoxin IV |
| FORMULA | C47H69N7O9 |
| MOLECULAR WEIGHT (Da) | 876.1090 |
| ACCURATE MASS (Da) | 875.5157 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Bipolaris |
| ORIGIN SPECIES | zeicola race 3 |
| InChIKey | HYRIAKASPMEAMO-VKJNQXOZSA-N |
| InChI | InChI=1S/C47H69N7O9/c1-11-29(7)38-45(60)48-26-37(55)49-31(9)41(56)50-34(24-32-19-15-13-16-20-32)43(58)53-39(30(8)12-2)47(62)63-40(28(5)6)46(61)54(10)36(23-27(3)4)44(59)51-35(42(57)52-38)25-33-21-17-14-18-22-33/h13-22,27-31,34-36,38-40H,11-12,23-26H2,1-10H3,(H,48,60)(H,49,55)(H,50,56)(H,51,59)(H,52,57)(H,53,58)/t29-,30-,31+,34-,35-,36-,38-,39-,40-/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2)CC(C)C)C)C(C)C)[C@@H](C)CC)CC3=CC=CC=C3)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ueda, Kazuo; Xiao, Jin-Zhong; Doke, Noriyuki; Nakatsuka, Shin-Ichi Isolation and structure of BZR-cotoxin IV produced by Bipolaris zeicola race 3, the cause of leaf spot disease in corn Tetrahedron Letters 1995 36 (5) 741-744. | ||
|---|---|---|---|
| DOI | 10.1016/0040-4039(94)02331-5 | PMID | - |
