Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577743 | Gold | 3 |
COMPOUND NPA021019
PROPERTIES
| NPAID | NPA021019 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Isariin B |
| FORMULA | C30H53N5O7 |
| MOLECULAR WEIGHT (Da) | 595.7820 |
| ACCURATE MASS (Da) | 595.3945 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Isaria |
| ORIGIN SPECIES | felina |
| InChIKey | QWBKHPNGPXORRV-WQVMVKNYSA-N |
| InChI | InChI=1S/C30H53N5O7/c1-9-10-11-12-13-21-15-23(36)31-16-24(37)34-25(18(4)5)29(40)33-22(14-17(2)3)28(39)32-20(8)27(38)35-26(19(6)7)30(41)42-21/h17-22,25-26H,9-16H2,1-8H3,(H,31,36)(H,32,39)(H,33,40)(H,34,37)(H,35,38)/t20-,21-,22+,25+,26+/m0/s1 |
| SMILES | CCCCCC[C@H]1CC(=O)NCC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O1)C(C)C)C)CC(C)C)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Deffieux G; Merlet D; Baute R; Bourgeois G; Baute MA; Neveu A New insecticidal cyclodepsipeptides from the fungus Isaria felina. II. Structure elucidation of isariins B, C and D. Journal of Antibiotics 1981 34 (10) 1266-1270. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.34.1266 | PMID | 7198112 |
