Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015898
PROPERTIES
| NPAID | NPA015898 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Hydroxycyclochlorotine A |
| FORMULA | C24H31Cl2N5O8 |
| MOLECULAR WEIGHT (Da) | 588.4450 |
| ACCURATE MASS (Da) | 587.1550 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | islandicum |
| InChIKey | SQOPWHUHNWXLMA-PQMJZOGWSA-N |
| InChI | InChI=1S/C24H31Cl2N5O8/c1-11(34)19-22(37)29-15(9-32)21(36)28-14(12-5-3-2-4-6-12)7-17(35)27-16(10-33)24(39)31-8-13(25)18(26)20(31)23(38)30-19/h2-6,11,13-16,18-20,32-34H,7-10H2,1H3,(H,27,35)(H,28,36)(H,29,37)(H,30,38)/t11-,13-,14-,15+,16+,18-,19+,20+/m1/s1 |
| SMILES | C[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](CC(=O)N[C@H](C(=O)N2C[C@H]([C@H]([C@H]2C(=O)N1)Cl)Cl)CO)C3=CC=CC=C3)CO)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Mizutani, Kohei; Hirasawa, Yusuke; Sugita-Konishi, Yoshiko; Mochizuki, Naoki; Morita, Hiroshi Structural and conformational analysis of hydroxycyclochlorotine and cyclochlorotine, chlorinated cyclic peptides from Penicillium islandicum Journal of Natural Products 2008 71 (7) 1297-1300. | ||
|---|---|---|---|
| DOI | 10.1021/np800150m | PMID | 18558744 |
