Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011669
PROPERTIES
| NPAID | NPA011669 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | (11)-Cytochalasa-6(12),13,19-triene-1,21-dione-16,18-dimethyl-7-hydroxy-lO-phenyl-(7S*,13E,16S*,18R*,19E) |
| FORMULA | C28H35NO3 |
| MOLECULAR WEIGHT (Da) | 433.5920 |
| ACCURATE MASS (Da) | 433.2617 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Daldinia |
| ORIGIN SPECIES | sp. |
| InChIKey | QPGWFFXHPZTAJK-QHHZZUTCSA-N |
| InChI | InChI=1S/C28H35NO3/c1-17-9-8-12-22-26(31)20(4)19(3)25-23(16-21-10-6-5-7-11-21)29-27(32)28(22,25)24(30)14-13-18(2)15-17/h5-8,10-14,17-19,22-23,25-26,31H,4,9,15-16H2,1-3H3,(H,29,32)/b12-8+,14-13+/t17-,18-,19+,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/[C@H](C1)C)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 | - |
