Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011085
PROPERTIES
| NPAID | NPA011085 |
|---|---|
| CLUSTER ID | 340 |
| NODE ID | 307 |
| NAME | Sordarin-3-carboxylic acid |
| FORMULA | C27H40O9 |
| MOLECULAR WEIGHT (Da) | 508.6080 |
| ACCURATE MASS (Da) | 508.2672 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | capreolus |
| InChIKey | VAVQCGVUDQEFIZ-GQCQILQESA-N |
| InChI | InChI=1S/C27H40O9/c1-12(2)18-8-15-9-26(23(30)31)17-7-6-13(3)16(17)10-25(15,27(18,26)24(32)33)11-35-22-20(29)19(28)21(34-5)14(4)36-22/h8,12-17,19-22,28-29H,6-7,9-11H2,1-5H3,(H,30,31)(H,32,33)/t13-,14?,15?,16-,17-,19?,20?,21?,22?,25?,26?,27?/m1/s1 |
| SMILES | C[C@@H]1CC[C@@H]2[C@@H]1CC3(C4CC2(C3(C(=C4)C(C)C)C(=O)O)C(=O)O)COC5C(C(C(C(O5)C)OC)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hall, R M; Dawson, M J; Jones, C A; Roberts, A D; Sidebottom, P J; Stead, P; Taylor, N L The production of novel sordarin analogues by biotransformation Journal of Antibiotics 2001 54 (11) 948-957. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.54.948 | PMID | 11827037 |
