Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017597
PROPERTIES
| NPAID | NPA017597 |
|---|---|
| CLUSTER ID | 4656 |
| NODE ID | 96 |
| NAME | Clonostachysin A |
| FORMULA | C53H87N9O10 |
| MOLECULAR WEIGHT (Da) | 1010.3320 |
| ACCURATE MASS (Da) | 1009.6576 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Clonostachys |
| ORIGIN SPECIES | rogersoniana (HJK9) |
| InChIKey | CUPJMPGVPHAKED-CBQDEJQESA-N |
| InChI | InChI=1S/C53H87N9O10/c1-19-34(8)45-53(71)56(12)36(10)48(66)55(11)30-43(63)57(13)42(28-32(4)5)51(69)62-26-20-21-39(62)49(67)58(14)40(29-37-22-24-38(72-18)25-23-37)46(64)54-35(9)47(65)60(16)44(33(6)7)52(70)59(15)41(27-31(2)3)50(68)61(45)17/h22-25,31-36,39-42,44-45H,19-21,26-30H2,1-18H3,(H,54,64)/t34-,35-,36-,39-,40-,41-,42-,44-,45-/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)N([C@H](C(=O)N(CC(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)CC(C)C)C)C(C)C)C)C)CC3=CC=C(C=C3)OC)C)CC(C)C)C)C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Adachi, Kyoko; Kanoh, Kaneo; Wisespongp, Puntip; Nishijima, Miyuki; Shizuri, Yoshikazu Clonostachysins A and B, new anti-dinoflagellate cyclic peptides from a marine-derived fungus Journal of Antibiotics 2005 58 (2) 145-150. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2005.17 | PMID | 15835726 |
