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. | ||
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DOI | 10.1002/ejoc.200200699 | PMID | - |