Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008609
PROPERTIES
| NPAID | NPA008609 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Penochalasin C |
| FORMULA | C32H35N3O3 |
| MOLECULAR WEIGHT (Da) | 509.6500 |
| ACCURATE MASS (Da) | 509.2678 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | CYRVQOQBMLPFPT-XJBGXHEWSA-N |
| InChI | InChI=1S/C32H35N3O3/c1-17-8-7-10-23-30(37)20(4)19(3)28-26(15-21-16-33-24-11-6-5-9-22(21)24)35-31(38)32(23,28)27-13-12-25(34-27)29(36)18(2)14-17/h5-7,9-14,16-17,19,23,26,28,30,33-34,37H,4,8,15H2,1-3H3,(H,35,38)/b10-7+,18-14+/t17-,19+,23-,26-,28-,30+,32+/m0/s1 |
| SMILES | C[C@H]\1C/C=C/[C@H]2[C@@H](C(=C)[C@H]([C@@H]3[C@@]2(C4=CC=C(N4)C(=O)/C(=C1)/C)C(=O)N[C@H]3CC5=CNC6=CC=CC=C65)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Numata, Atsushi; Takahashi, Chika; Ito, Yoshinori; Minoura, Katsuhiko; Yamada, Takeshi; Matsuda, Chitose; Nomoto, Kyosuke Penochalasins, a novel class of cytotoxic cytochalasans from a Penicillium species separated from a marine alga: structure determination and solution conformation Journal of the Chemical Society, Perkin Transactions 1 1996 (3) 239-245. | ||
|---|---|---|---|
| DOI | 10.1039/p19960000239 | PMID | - |
