Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018224
PROPERTIES
| NPAID | NPA018224 |
|---|---|
| CLUSTER ID | 193 |
| NODE ID | 181 |
| NAME | Marcfortine A |
| FORMULA | C28H35N3O4 |
| MOLECULAR WEIGHT (Da) | 477.6050 |
| ACCURATE MASS (Da) | 477.2628 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | roqueforti |
| InChIKey | KYKUTNUWXQVSSU-ZALBMCOMSA-N |
| InChI | InChI=1S/C28H35N3O4/c1-24(2)11-13-34-21-18(35-24)9-8-17-20(21)29-22(32)28(17)15-27-16-31-12-7-6-10-26(31,23(33)30(27)5)14-19(27)25(28,3)4/h8-9,11,13,19H,6-7,10,12,14-16H2,1-5H3,(H,29,32)/t19-,26-,27+,28+/m0/s1 |
| SMILES | CC1(C=COC2=C(O1)C=CC3=C2NC(=O)[C@@]34C[C@@]56CN7CCCC[C@]7(C[C@H]5C4(C)C)C(=O)N6C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Polonsky, Judith; Merrien, Marie-Annick; Prangé, Thierry; Pascard, Claudine; Moreau, Serge Isolation and structure (X-ray analysis) of marcfortine A, a new alkaloid from Penicillium roqueforti Journal of the Chemical Society, Chemical Communications 1980 (13) 601-602. | ||
|---|---|---|---|
| DOI | 10.1039/c39800000601 | PMID | - |
