Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001740
PROPERTIES
| NPAID | NPA001740 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | (11)-Cytochalasa-6(12),13-diene-1,21-dione-7,9-dihydroxy-16,18-dimethyl-lO-phenyl-(7S*,13E,16S*,18R*,19R*) |
| FORMULA | C28H37NO4 |
| MOLECULAR WEIGHT (Da) | 451.6070 |
| ACCURATE MASS (Da) | 451.2723 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | sp. |
| InChIKey | PKVSDBKCEFZRDL-YBMVXGEQSA-N |
| InChI | InChI=1S/C28H37NO4/c1-16-9-8-12-21-26(32)19(4)18(3)25-22(14-20-10-6-5-7-11-20)29-27(33)28(21,25)24(31)15-23(30)17(2)13-16/h5-8,10-12,16-18,21-23,25-26,30,32H,4,9,13-15H2,1-3H3,(H,29,33)/b12-8+/t16-,17+,18+,21-,22-,23+,25-,26+,28+/m1/s1 |
| SMILES | C[C@@H]1C/C=C/[C@@H]2[C@H](C(=C)[C@@H]([C@H]3[C@]2(C(=O)C[C@@H]([C@H](C1)C)O)C(=O)N[C@@H]3CC4=CC=CC=C4)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Buchanan, Malcolm S.; Hashimoto, Toshihiro; Asakawa, Yoshinori Cytochalasins from a Daldinia sp. of fungus Phytochemistry 1996 41 (3) 821-828. | ||
|---|---|---|---|
| DOI | 10.1016/0031-9422(95)00644-3 | PMID | - |
