Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA009608
PROPERTIES
| NPAID | NPA009608 |
|---|---|
| CLUSTER ID | 248 |
| NODE ID | 11 |
| NAME | Gageostatin A |
| FORMULA | C52H93N7O14 |
| MOLECULAR WEIGHT (Da) | 1040.3510 |
| ACCURATE MASS (Da) | 1039.6781 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | sp. SNA-60-367 |
| InChIKey | ASKJUGVPESKJDD-YNEMRZIYSA-N |
| InChI | InChI=1S/C52H93N7O14/c1-13-34(12)19-17-15-14-16-18-20-35(60)27-42(61)53-36(21-22-43(62)63)46(66)54-37(23-29(2)3)47(67)56-39(25-31(6)7)50(70)59-45(33(10)11)51(71)57-40(28-44(64)65)49(69)55-38(24-30(4)5)48(68)58-41(52(72)73)26-32(8)9/h29-41,45,60H,13-28H2,1-12H3,(H,53,61)(H,54,66)(H,55,69)(H,56,67)(H,57,71)(H,58,68)(H,59,70)(H,62,63)(H,64,65)(H,72,73)/t34?,35-,36+,37+,38+,39+,40+,41+,45-/m1/s1 |
| SMILES | CCC(C)CCCCCCC[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tareq, Fakir Shahidullah; Lee, Min Ah; Lee, Hyi-Seung; Lee, Jong-Seok; Lee, Yeon-Ju; Shin, Hee Jae Gageostatins A-C, antimicrobial linear lipopeptides from a marine Bacillus subtilis Marine Drugs 2014 12 (2) 871-885. | ||
|---|---|---|---|
| DOI | 10.3390/md12020871 | PMID | 24492520 |
