Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019890
PROPERTIES
| NPAID | NPA019890 |
|---|---|
| CLUSTER ID | 368 |
| NODE ID | 332 |
| NAME | Chrondramide 13E |
| FORMULA | C36H45BrN4O6 |
| MOLECULAR WEIGHT (Da) | 709.6820 |
| ACCURATE MASS (Da) | 708.2522 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Chondromyces |
| ORIGIN SPECIES | sp. MSr9030 |
| InChIKey | DFOJMCFNHSDGNF-DCNVGBKBSA-N |
| InChI | InChI=1S/C36H45BrN4O6/c1-7-32-21(3)14-20(2)15-22(4)34(44)39-23(5)36(46)41(6)30(17-25-19-38-28-11-9-8-10-26(25)28)35(45)40-29(18-33(43)47-32)24-12-13-31(42)27(37)16-24/h8-14,16,19,21-23,29-30,32,38,42H,7,15,17-18H2,1-6H3,(H,39,44)(H,40,45)/b20-14-/t21-,22-,23-,29?,30+,32+/m0/s1 |
| SMILES | CC[C@@H]1[C@H](/C=C(\C[C@@H](C(=O)N[C@H](C(=O)N([C@@H](C(=O)NC(CC(=O)O1)C2=CC(=C(C=C2)O)Br)CC3=CNC4=CC=CC=C43)C)C)C)/C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Herrmann, Jennifer; Hüttel, Stephan; Müller, Rolf Discovery and Biological Activity of New Chondramides from Chondromyces sp ChemBioChem 2013 14 (13) 1573-1580. | ||
|---|---|---|---|
| DOI | 10.1002/cbic.201300140 | PMID | 23959765 |
