Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000508
PROPERTIES
| NPAID | NPA000508 |
|---|---|
| CLUSTER ID | 393 |
| NODE ID | 354 |
| NAME | Chondrochloren A |
| FORMULA | C27H40ClNO7 |
| MOLECULAR WEIGHT (Da) | 526.0700 |
| ACCURATE MASS (Da) | 525.2493 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Chondromyces |
| ORIGIN SPECIES | crocatus |
| InChIKey | FYBGSKAWXCBCIQ-JRAUAZSASA-N |
| InChI | InChI=1S/C27H40ClNO7/c1-7-8-9-16(2)23(31)18(4)24(32)17(3)14-22(35-5)25(33)26(36-6)27(34)29-13-12-19-10-11-21(30)20(28)15-19/h10-16,18,22-23,25-26,30-31,33H,7-9H2,1-6H3,(H,29,34)/b13-12-,17-14+/t16-,18+,22-,23+,25-,26-/m1/s1 |
| SMILES | CCCC[C@@H](C)[C@@H]([C@H](C)C(=O)/C(=C/[C@H]([C@H]([C@H](C(=O)N/C=C\C1=CC(=C(C=C1)O)Cl)OC)O)OC)/C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jansen, Rolf; Kunze, Brigitte; Reichenbach, Hans; Höfle, Gerhard Chondrochloren A and B, New β-Amino Styrenes from Chondromyces crocatus (Myxobacteria) European Journal of Organic Chemistry 2003 2003 (14) 2684-2689. | ||
|---|---|---|---|
| DOI | 10.1002/ejoc.200200699 | PMID | - |
