Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA031084
PROPERTIES
NPAID | NPA031084 |
---|---|
CLUSTER ID | 9042 |
NODE ID | 6084 |
NAME | Phallusialide B |
FORMULA | C18H27BrN2O6 |
MOLECULAR WEIGHT (Da) | 447.3260 |
ACCURATE MASS (Da) | 446.1052 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Micromonospora |
ORIGIN SPECIES | sp. |
InChIKey | DRLYHNKGAYRXPD-GYOGUEERSA-N |
InChI | InChI=1S/C18H27BrN2O6/c1-9-13(26-17(23)12-6-11(19)8-21-12)4-5-15(25-9)27-16-10(2)24-14(22)7-18(16,3)20/h6,8-10,13-16,21-22H,4-5,7,20H2,1-3H3/t9-,10+,13+,14-,15+,16+,18-/m1/s1 |
SMILES | C[C@@H]1O[C@@H](O)C[C@@](C)(N)[C@H]1O[C@H]1CC[C@H](OC(=O)C2=CC(Br)=CN2)[C@@H](C)O1 |
ORIGINAL ISOLATION REFERENCE
CITATION | Zhang, F; Braun, DR; Chanana, S; Rajski, SR; Bugni, TS Phallusialides A-E, Pyrrole-Derived Alkaloids Discovered from a Marine-Derived Micromonospora sp. Bacterium Using MS-Based Metabolomics Approaches. Journal of Natural Products 2019 82 (12) 3432-3439. | ||
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DOI | 10.1021/acs.jnatprod.9b00808 | PMID | 31794218 |