Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017962
PROPERTIES
| NPAID | NPA017962 |
|---|---|
| CLUSTER ID | 490 |
| NODE ID | 440 |
| NAME | Fumonisin C4 |
| FORMULA | C33H57NO13 |
| MOLECULAR WEIGHT (Da) | 675.8130 |
| ACCURATE MASS (Da) | 675.3830 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Fusarium |
| ORIGIN SPECIES | moniliforme |
| InChIKey | XRBVYXJCGATDLV-ZRQMLQCCSA-N |
| InChI | InChI=1S/C33H57NO13/c1-4-5-13-22(3)31(47-30(41)19-24(33(44)45)17-28(38)39)26(46-29(40)18-23(32(42)43)16-27(36)37)15-21(2)12-10-8-6-7-9-11-14-25(35)20-34/h21-26,31,35H,4-20,34H2,1-3H3,(H,36,37)(H,38,39)(H,42,43)(H,44,45)/t21-,22+,23?,24?,25-,26-,31+/m0/s1 |
| SMILES | CCCC[C@@H](C)[C@H]([C@H](C[C@@H](C)CCCCCCCC[C@@H](CN)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Plattner, R D Detection of fumonisins produced in Fusarium moniliforme cultures by HPLC with electrospray MS and evaporative light scattering detectors Natural Toxins 1995 3 (4) 294-298. | ||
|---|---|---|---|
| DOI | 10.1002/nt.2620030424 | PMID | 7582632 |
