Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009453
PROPERTIES
NPAID | NPA009453 |
---|---|
CLUSTER ID | 1861 |
NODE ID | 1504 |
NAME | Siphonazole |
FORMULA | C25H25N3O6 |
MOLECULAR WEIGHT (Da) | 463.4900 |
ACCURATE MASS (Da) | 463.1743 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Herpetosiphon |
ORIGIN SPECIES | sp. |
InChIKey | PJVVMJIQCNHSKW-RXUIJTJXSA-N |
InChI | InChI=1S/C25H25N3O6/c1-5-6-7-12-26-25(31)24-16(3)34-22(28-24)14-19(30)23-15(2)33-21(27-23)11-9-17-8-10-20(32-4)18(29)13-17/h5-11,13,29H,1,12,14H2,2-4H3,(H,26,31)/b7-6+,11-9+ |
SMILES | CC1=C(N=C(O1)CC(=O)C2=C(OC(=N2)/C=C/C3=CC(=C(C=C3)OC)O)C)C(=O)NC/C=C/C=C |
ORIGINAL ISOLATION REFERENCE
CITATION | Nett, Markus; Erol, Ozlem; Kehraus, Stefan; Köck, Matthias; Krick, Anja; Eguereva, Ekaterina; Neu, Edith; König, Gabriele M Siphonazole, an unusual metabolite from Herpetosiphon sp Angewandte Chemie International Edition 2006 45 (23) 3863-3867. | ||
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DOI | 10.1002/anie.200504525 | PMID | 16671154 |