Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021181
PROPERTIES
| NPAID | NPA021181 |
|---|---|
| CLUSTER ID | 5591 |
| NODE ID | 3958 |
| NAME | N-demethylcelesticetin |
| FORMULA | C23H34N2O9S |
| MOLECULAR WEIGHT (Da) | 514.5970 |
| ACCURATE MASS (Da) | 514.1985 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | caelestis strain 22218a |
| InChIKey | JGNMAXOBERVZHJ-FWXYZYEUSA-N |
| InChI | InChI=1S/C23H34N2O9S/c1-12(32-2)16(25-21(30)14-7-5-9-24-14)20-18(28)17(27)19(29)23(34-20)35-11-10-33-22(31)13-6-3-4-8-15(13)26/h3-4,6,8,12,14,16-20,23-24,26-29H,5,7,9-11H2,1-2H3,(H,25,30)/t12-,14+,16-,17+,18-,19-,20+,23-/m1/s1 |
| SMILES | C[C@H]([C@H]([C@H]1[C@@H]([C@@H]([C@H]([C@H](O1)SCCOC(=O)C2=CC=CC=C2O)O)O)O)NC(=O)[C@@H]3CCCN3)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Argoudelis AD; Coats JH; Lemaux PG; Sebek OK Antibiotics produced by mutants of Streptomyces caelestis. II. N-demethylcelesticetin and N-demethyl-7-O-demethylcelesticetin. Journal of Antibiotics 1973 26 (1) 7-14. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.26.7 | PMID | 4781281 |
