Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010386
PROPERTIES
| NPAID | NPA010386 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Cyanopeptolin D |
| FORMULA | C48H76N8O12 |
| MOLECULAR WEIGHT (Da) | 957.1800 |
| ACCURATE MASS (Da) | 956.5583 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microcystis |
| ORIGIN SPECIES | sp. PCC 7806 |
| InChIKey | DXELFTOXIMDPAT-HWSHAAQKSA-N |
| InChI | InChI=1S/C48H76N8O12/c1-10-11-13-21-37(57)49-34(27-39(59)60)43(62)53-41-30(6)68-48(67)40(29(4)5)52-44(63)35(26-31-18-14-12-15-19-31)55(9)47(66)36(25-28(2)3)56-38(58)23-22-33(46(56)65)51-42(61)32(50-45(41)64)20-16-17-24-54(7)8/h12,14-15,18-19,28-30,32-36,38,40-41,58H,10-11,13,16-17,20-27H2,1-9H3,(H,49,57)(H,50,64)(H,51,61)(H,52,63)(H,53,62)(H,59,60)/t30-,32+,33+,34+,35+,36+,38-,40+,41+/m1/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)CCCCN(C)C)O)CC(C)C)C)CC3=CC=CC=C3)C(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Martin; Oberer; Ino; Konig; Busch; Weckesser Cyanopeptolins, new depsipeptides from the cyanobacterium Microcystis sp. PCC 7806 Journal of Antibiotics 1993 46 (10) 1550-1556. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.46.1550 | PMID | 8244882 |
