Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001655
PROPERTIES
| NPAID | NPA001655 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Micropeptin SF995 |
| FORMULA | C48H73N11O12 |
| MOLECULAR WEIGHT (Da) | 996.1770 |
| ACCURATE MASS (Da) | 995.5440 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. |
| InChIKey | TWXCIJLXMTYXKC-ASZZHDLXSA-N |
| InChI | InChI=1S/C48H73N11O12/c1-8-10-11-18-35(60)53-33(23-37(62)63)42(65)57-39-27(6)71-47(70)38(25(3)4)56-43(66)34(22-28-24-52-30-16-13-12-15-29(28)30)58(7)46(69)40(26(5)9-2)59-36(61)20-19-32(45(59)68)55-41(64)31(54-44(39)67)17-14-21-51-48(49)50/h12-13,15-16,24-27,31-34,36,38-40,52,61H,8-11,14,17-23H2,1-7H3,(H,53,60)(H,54,67)(H,55,64)(H,56,66)(H,57,65)(H,62,63)(H4,49,50,51)/t26-,27+,31-,32-,33-,34-,36+,38-,39-,40-/m0/s1 |
| SMILES | CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCN=C(N)N)O)[C@@H](C)CC)C)CC3=CNC4=CC=CC=C43)C(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Banker, Ronny; Carmeli, Shmuel Inhibitors of serine proteases from a waterbloom of the cyanobacterium Microcystis sp Tetrahedron 1999 55 (35) 10835-10844. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4020(99)00597-9 | PMID | - |
