Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021421
PROPERTIES
| NPAID | NPA021421 |
|---|---|
| CLUSTER ID | 2786 |
| NODE ID | 2150 |
| NAME | 3-hydroxyrifamycin S |
| FORMULA | C37H45NO13 |
| MOLECULAR WEIGHT (Da) | 711.7610 |
| ACCURATE MASS (Da) | 711.2891 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nocardia |
| ORIGIN SPECIES | mediterranei R-12 |
| InChIKey | RHKLJQICQQSACY-HBMAFQNGSA-N |
| InChI | InChI=1S/C37H45NO13/c1-15-11-10-12-16(2)36(47)38-26-30(43)24-23(31(44)32(26)45)25-34(20(6)29(24)42)51-37(8,35(25)46)49-14-13-22(48-9)17(3)33(50-21(7)39)19(5)28(41)18(4)27(15)40/h10-15,17-19,22,27-28,33,40-43H,1-9H3,(H,38,47)/b11-10+,14-13+,16-12-/t15-,17+,18+,19+,22-,27-,28+,33+,37-/m0/s1 |
| SMILES | C[C@H]1/C=C/C=C(\C(=O)NC2=C(C3=C(C(=C4C(=C3C(=O)C2=O)C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Traxler P; Schupp T; Fuhrer H; Richter WJ 3-HYDROXYRIFAMYCIN S AND FURTHER NOVEL ANSAMYCINS FROM A RECOMBINANT STRAIN R-21 OF NOCARDIA MEDITERRANEI Journal of Antibiotics 1981 34 (8) 971-979. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.34.971 | PMID | 7319930 |
