Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027371
PROPERTIES
| NPAID | NPA027371 |
|---|---|
| CLUSTER ID | 867 |
| NODE ID | 141 |
| NAME | Puwainaphycin G |
| FORMULA | C54H89N13O15 |
| MOLECULAR WEIGHT (Da) | 1160.3820 |
| ACCURATE MASS (Da) | 1159.6601 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Cylindrospermopsis |
| ORIGIN SPECIES | alatosporum C24/89 |
| InChIKey | AHLZFNFPKBUJRB-BJLHTMEBSA-N |
| InChI | InChI=1S/C54H89N13O15/c1-10-13-14-15-16-17-18-19-21-29(6)42-44(72)52(80)63-41(28(4)5)51(79)60-33(12-3)46(74)61-34(23-24-38(55)69)48(76)59-32(11-2)47(75)62-35(26-39(56)70)49(77)58-30(7)45(73)65-43(31(8)68)54(82)66(9)37(27-40(57)71)53(81)67-25-20-22-36(67)50(78)64-42/h11-12,28-31,34-37,41-44,68,72H,10,13-27H2,1-9H3,(H2,55,69)(H2,56,70)(H2,57,71)(H,58,77)(H,59,76)(H,60,79)(H,61,74)(H,62,75)(H,63,80)(H,64,78)(H,65,73)/b32-11+,33-12+/t29?,30-,31-,34-,35-,36-,37-,41-,42?,43+,44?/m0/s1 |
| SMILES | C/C=C1/NC(=O)[C@H](CCC(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 |
