Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013436
PROPERTIES
| NPAID | NPA013436 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Langkocycline A1 |
| FORMULA | C31H36O12 |
| MOLECULAR WEIGHT (Da) | 600.6170 |
| ACCURATE MASS (Da) | 600.2207 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. Acta 3034 |
| InChIKey | UKEUSFCSLQPUQI-BKYHCZRISA-N |
| InChI | InChI=1S/C31H36O12/c1-14-20(42-23-11-19(33)26(35)15(2)41-23)7-8-22(40-14)43-31-21(34)12-29(3,38)13-30(31,39)10-9-17-25(31)28(37)16-5-4-6-18(32)24(16)27(17)36/h4-6,9-10,14-15,19-20,22-23,26,32-33,35,38-39H,7-8,11-13H2,1-3H3/t14-,15+,19+,20-,22-,23-,26+,29-,30-,31-/m0/s1 |
| SMILES | C[C@H]1[C@H](CC[C@@H](O1)O[C@]23C(=O)C[C@](C[C@]2(C=CC4=C3C(=O)C5=C(C4=O)C(=CC=C5)O)O)(C)O)O[C@H]6C[C@H]([C@@H]([C@H](O6)C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kalyon, Bahar; Tan, Geok-Yuan A; Pinto, John M; Foo, Cheau-Yee; Wiese, Jutta; Imhoff, Johannes F; Suessmuth, Roderich D; Sabaratnam, Vikineswary; Fiedler, Hans-Peter Langkocyclines: Novel angucycline antibiotics from Streptomyces sp. Acta 3034 Journal of Antibiotics 2013 66 (10) 609-616. | ||
|---|---|---|---|
| DOI | 10.1038/ja.2013.53 | PMID | 23820614 |
