Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001797
PROPERTIES
| NPAID | NPA001797 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | RKS-1778 |
| FORMULA | C30H39NO4 |
| MOLECULAR WEIGHT (Da) | 477.6450 |
| ACCURATE MASS (Da) | 477.2879 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Phoma |
| ORIGIN SPECIES | sp. SNF-1778 |
| InChIKey | LYHWACCLUSDGME-HTGZJUKKSA-N |
| InChI | InChI=1S/C30H39NO4/c1-19-10-9-13-24-16-20(2)21(3)27-25(17-23-11-7-6-8-12-23)31-28(33)30(24,27)26(35-22(4)32)14-15-29(5,34)18-19/h6-9,11-16,19,21,24-27,34H,10,17-18H2,1-5H3,(H,31,33)/b13-9+,15-14+/t19-,21+,24-,25-,26+,27-,29-,30+/m0/s1 |
| SMILES | C[C@H]1C/C=C/[C@H]2C=C([C@H]([C@@H]3[C@@]2([C@@H](/C=C/[C@](C1)(C)O)OC(=O)C)C(=O)N[C@H]3CC4=CC=CC=C4)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kakeya, Hideaki; Morishita, Masayuki; Onozawa, Chizuko; Usami, Ron; Horikoshi, Koki; Kimura, Ken-Ichi; Yoshihama, Makoto; Osada, Hiroyuki RKS-1778, a new mammalian cell-cycle inhibitor and a key intermediate of the [11]cytochalasin group Journal of Natural Products 1997 60 (7) 669-672. | ||
|---|---|---|---|
| DOI | 10.1021/np970151o | PMID | 9249969 |
