Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019387
PROPERTIES
| NPAID | NPA019387 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Isochaetoglobosin J |
| FORMULA | C32H36N2O4 |
| MOLECULAR WEIGHT (Da) | 512.6500 |
| ACCURATE MASS (Da) | 512.2675 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Chaetomium |
| ORIGIN SPECIES | globosum TW1-1 |
| InChIKey | DWPNLDBISFNQGI-NJHZBBGFSA-N |
| InChI | InChI=1S/C32H36N2O4/c1-18-8-7-9-23-15-19(2)21(4)29-26(16-22-17-33-25-11-6-5-10-24(22)25)34-31(38)32(23,29)28(36)13-12-27(35)30(37)20(3)14-18/h5-7,9-11,14-15,17-18,21,23,26,29,33H,8,12-13,16H2,1-4H3,(H,34,38)/t18-,21+,23-,26-,29-,32+/m0/s1 |
| SMILES | C[C@H]1CC=C[C@H]2C=C([C@H]([C@@H]3[C@@]2(C(=O)CCC(=O)C(=O)C(=C1)C)C(=O)N[C@H]3CC4=CNC5=CC=CC=C54)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oikawa, Hideaki; Murakami, Yasunobu; Ichihara, Akitami Useful approach to find the plausible biosynthetic precursors of secondary metabolites using P-450 inhibitors: postulated intermediates of chaetoglobosin A Journal of the Chemical Society, Perkin Transactions 1 1992 (21) 2949-2953. | ||
|---|---|---|---|
| DOI | 10.1039/p19920002949 | PMID | - |
