Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000001811 | Gold | 1!CCMSLIB00000001812 |
COMPOUND NPA002623
PROPERTIES
| NPAID | NPA002623 |
|---|---|
| CLUSTER ID | 1543 |
| NODE ID | 1267 |
| NAME | Hoiamide C |
| FORMULA | C37H62N4O7S3 |
| MOLECULAR WEIGHT (Da) | 771.1250 |
| ACCURATE MASS (Da) | 770.3781 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Symploca |
| ORIGIN SPECIES | sp. |
| InChIKey | STGNMXQTWDOGSE-FUVSMVGWSA-N |
| InChI | InChI=1S/C37H62N4O7S3/c1-12-15-21(5)29(42)23(7)30(43)22(6)26(47-11)16-27-38-25(17-49-27)32-40-37(10,19-50-32)35-41-36(9,18-51-35)34(46)39-28(20(4)13-2)31(44)24(8)33(45)48-14-3/h17,20-24,26,28-31,42-44H,12-16,18-19H2,1-11H3,(H,39,46)/t20-,21+,22-,23-,24+,26-,28-,29-,30-,31-,36+,37+/m0/s1 |
| SMILES | CCC[C@@H](C)[C@@H]([C@H](C)[C@H]([C@@H](C)[C@H](CC1=NC(=CS1)C2=N[C@@](CS2)(C)C3=N[C@@](CS3)(C)C(=O)N[C@@H]([C@@H](C)CC)[C@H]([C@@H](C)C(=O)OCC)O)OC)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Choi, Hyukjae; Pereira, Alban R.; Cao, Zhengyu; Shuman, Cynthia F.; Engene, Niclas; Byrum, Tara; Matainaho, Teatulohi; Murray, Thomas F.; Mangoni, Alfonso; Gerwick, William H. The Hoiamides, Structurally Intriguing Neurotoxic Lipopeptides from Papua New Guinea Marine Cyanobacteria Journal of Natural Products 2010 73 (8) 1411-1421. | ||
|---|---|---|---|
| DOI | 10.1021/np100468n | PMID | 20687534 |
SYNTHESES
| CITATION 1 | Wang L; Xu Z; Ye T Total synthesis of hoiamide C. Organic Letters 2011 13 (9) 2506-9. DOI: 10.1021/ol2007567 PMID: 21473628 | ||
|---|---|---|---|
