Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015985
PROPERTIES
| NPAID | NPA015985 |
|---|---|
| CLUSTER ID | 3930 |
| NODE ID | 2903 |
| NAME | Malbranpyrrole B |
| FORMULA | C20H23NO3 |
| MOLECULAR WEIGHT (Da) | 325.4080 |
| ACCURATE MASS (Da) | 325.1678 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Saccharomyces |
| ORIGIN SPECIES | cerevisiae |
| InChIKey | MBCKESWYYQOLQM-MVKOLZDDSA-N |
| InChI | InChI=1S/C20H23NO3/c1-12(11-15-7-6-10-21-15)8-9-16-13(2)18-17(19(22)24-16)20(4,5)14(3)23-18/h6-11,14,21H,1-5H3/b9-8+,12-11+ |
| SMILES | CC1C(C2=C(O1)C(=C(OC2=O)/C=C/C(=C/C3=CC=CN3)/C)C)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yang, Yu-Liang; Liao, Wen-Ying; Liu, Wan-Yun; Liaw, Chih-Chuang; Shen, Chia-Ning; Huang, Zih-You; Wu, Shih-Hsiung Discovery of new natural products by intact-cell mass spectrometry and LC-SPE-NMR: malbranpyrroles, novel polyketides from thermophilic fungus Malbranchea sulfurea Chemistry - A European Journal 2009 15 (43) 11573-11580. | ||
|---|---|---|---|
| DOI | 10.1002/chem.200901556 | PMID | 19768713 |
