Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000577726 | Gold | 3 |
COMPOUND NPA018907
PROPERTIES
| NPAID | NPA018907 |
|---|---|
| CLUSTER ID | 2425 |
| NODE ID | 1824 |
| NAME | Efrapeptin J |
| FORMULA | C81H139N18O16+ |
| MOLECULAR WEIGHT (Da) | 1621.1130 |
| ACCURATE MASS (Da) | 1620.0611 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Tolypocladium |
| ORIGIN SPECIES | sp. |
| InChIKey | FPZWWNKQAQRXAV-UHFFFAOYSA-O |
| InChI | InChI=1S/C81H138N18O16/c1-48(2)43-53(47-96-39-30-38-95-37-29-34-61(95)96)85-69(110)76(11,12)89-64(105)55(45-50(5)6)86-62(103)51(7)84-68(109)75(9,10)90-66(107)57-32-25-28-42-99(57)74(115)81(21,22)94-71(112)78(15,16)88-60(102)46-83-59(101)35-36-82-63(104)54(44-49(3)4)87-70(111)77(13,14)93-72(113)79(17,18)91-67(108)58-33-24-27-41-98(58)73(114)80(19,20)92-65(106)56-31-23-26-40-97(56)52(8)100/h48-51,53-58H,23-47H2,1-22H3,(H12-,82,83,84,85,86,87,88,89,90,91,92,93,94,101,102,103,104,105,106,107,108,109,110,111,112,113)/p+1 |
| SMILES | CC(C)CC(CN1CCC[N+]2=C1CCC2)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C3CCCCN3C(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)CNC(=O)CCNC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C4CCCCN4C(=O)C(C)(C)NC(=O)C5CCCCN5C(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hayakawa, Yoichi; Hattori, Yuki; Kawasaki, Takashi; Kanoh, Kaneo; Adachi, Kyoko; Shizuri, Yoshikazu; Shin-ya, Kazuo Efrapeptin J, a New Down-regulator of the Molecular Chaperone GRP78 from a Marine Tolypocladium sp Journal of Antibiotics 2008 61 (6) 365-371. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2008.51 | PMID | 18667784 |
