Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008489
PROPERTIES
| NPAID | NPA008489 |
|---|---|
| CLUSTER ID | 3631 |
| NODE ID | 2731 |
| NAME | Precorallopyronin A |
| FORMULA | C30H41NO6 |
| MOLECULAR WEIGHT (Da) | 511.6590 |
| ACCURATE MASS (Da) | 511.2934 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Corallococcus |
| ORIGIN SPECIES | coralloides B035 |
| InChIKey | XBYLKVPPVUSZLM-SYCFNXJJSA-N |
| InChI | InChI=1S/C30H41NO6/c1-7-8-9-13-21(2)14-12-15-22(3)17-18-24(5)28(33)27-25(32)20-26(37-29(27)34)23(4)16-10-11-19-31-30(35)36-6/h7-8,11,13,17-20,23,32H,9-10,12,14-16H2,1-6H3,(H,31,35)/b8-7?,19-11?,21-13-,22-17?,24-18?/t23-/m1/s1 |
| SMILES | CC=CC/C=C(/C)\CCCC(=CC=C(C)C(=O)C1=C(C=C(OC1=O)[C@H](C)CCC=CNC(=O)OC)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Schäberle, Till F.; Schmitz, Alexander; Zocher, Georg; Schiefer, Andrea; Kehraus, Stefan; Neu, Edith; Roth, Martin; Vassylyev, Dmitry G.; Stehle, Thilo; Bierbaum, Gabriele; Hoerauf, Achim; Pfarr, Kenneth; König, Gabriele M. Insights into Structure-Activity Relationships of Bacterial RNA Polymerase Inhibiting Corallopyronin Derivatives Journal of Natural Products 2015 78 (10) 2505-2509. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.5b00175 | PMID | 26431157 |
