Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027370
PROPERTIES
| NPAID | NPA027370 |
|---|---|
| CLUSTER ID | 867 |
| NODE ID | 141 |
| NAME | Puwainaphycin F |
| FORMULA | C53H87N13O15 |
| MOLECULAR WEIGHT (Da) | 1146.3550 |
| ACCURATE MASS (Da) | 1145.6445 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Cylindrospermopsis |
| ORIGIN SPECIES | alatosporum C24/89 |
| InChIKey | OGEPEQGQPSWALS-BMIHFYDPSA-N |
| InChI | InChI=1S/C53H87N13O15/c1-10-13-14-15-16-17-18-19-21-28(6)41-43(71)51(79)62-40(27(4)5)50(78)59-32(12-3)46(74)61-34(25-38(55)69)48(76)58-31(11-2)45(73)60-33(24-37(54)68)47(75)57-29(7)44(72)64-42(30(8)67)53(81)65(9)36(26-39(56)70)52(80)66-23-20-22-35(66)49(77)63-41/h11-12,27-30,33-36,40-43,67,71H,10,13-26H2,1-9H3,(H2,54,68)(H2,55,69)(H2,56,70)(H,57,75)(H,58,76)(H,59,78)(H,60,73)(H,61,74)(H,62,79)(H,63,77)(H,64,72)/b31-11+,32-12+/t28?,29-,30-,33-,34-,35-,36-,40-,41?,42+,43?/m0/s1 |
| SMILES | C/C=C1/NC(=O)[C@H](CC(N)=O)NC(=O)/C(=C\C)NC(=O)[C@H](C(C)C)NC(=O)C(O)C(C(C)CCCCCCCCCC)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(N)=O)N(C)C(=O)[C@@H]([C@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hrouzek P; Kuzma M; Černý J; Novák P; Fišer R; Simek P; Lukešová A; Kopecký J The cyanobacterial cyclic lipopeptides puwainaphycins F/G are inducing necrosis via cell membrane permeabilization and subsequent unusual actin relocalization. Chemical Research in Toxicology 2012 25 (6) 1203-1211. | ||
|---|---|---|---|
| DOI | 10.1021/tx300044t | PMID | 22551534 |
