Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020962
PROPERTIES
| NPAID | NPA020962 |
|---|---|
| CLUSTER ID | 6578 |
| NODE ID | 4558 |
| NAME | Deoxypentalenylglucuron |
| FORMULA | C21H30O8 |
| MOLECULAR WEIGHT (Da) | 410.4630 |
| ACCURATE MASS (Da) | 410.1941 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | omiyaensis |
| InChIKey | BFYOGFPGIVIQCC-UPUKJNKPSA-N |
| InChI | InChI=1S/C21H30O8/c1-9-4-5-12-11(6-10-7-20(2,3)8-21(9,10)12)18(27)29-19-15(24)13(22)14(23)16(28-19)17(25)26/h6,9-10,12-16,19,22-24H,4-5,7-8H2,1-3H3,(H,25,26)/t9-,10-,12+,13+,14+,15+,16+,19+,21-/m1/s1 |
| SMILES | C[C@@H]1CC[C@@H]2[C@]13CC(C[C@H]3C=C2C(=O)O[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Takahashi S; Takeuchi M; Arai M; Seto H; Otake N Studies on biosynthesis of pentalenolactone. V isolation of deoxypentalenylglucuron. Journal of Antibiotics 1983 36 (3) 226-228. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.36.226 | PMID | 6833143 |
