Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002124
PROPERTIES
| NPAID | NPA002124 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Neobulgarone C/D |
| FORMULA | C32H25ClO8 |
| MOLECULAR WEIGHT (Da) | 572.9970 |
| ACCURATE MASS (Da) | 572.1238 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Neobulgaria |
| ORIGIN SPECIES | pura |
| InChIKey | XTZHVTOVVQVQKP-UHFFFAOYSA-N |
| InChI | InChI=1S/C32H25ClO8/c1-12-5-15-23(17-9-14(34)10-18(35)24(17)31(38)25(15)21(7-12)40-3)27-16-6-13(2)8-22(41-4)26(16)32(39)28-19(36)11-20(37)30(33)29(27)28/h5-11,23,27,34-37H,1-4H3 |
| SMILES | CC1=CC(=C2C(=C1)C(C3=CC(=CC(=C3C2=O)O)O)C4C5=CC(=CC(=C5C(=O)C6=C4C(=C(C=C6O)O)Cl)OC)C)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Eilbert; Anke; Sterner Neobulgarones A~F from cultures of Neobulgaria pura, new inhibitors of appressorium formation of magnaporthe grisea Journal of Antibiotics 2000 53 (10) 1123-1129. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.53.1123 | PMID | 11132957 |
