Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00005720203 | Gold | 3 |
| CCMSLIB00005720204 | Gold | 3 |
| CCMSLIB00005720205 | Gold | 3 |
COMPOUND NPA020026
PROPERTIES
| NPAID | NPA020026 |
|---|---|
| CLUSTER ID | 1335 |
| NODE ID | 1126 |
| NAME | FR900359 |
| FORMULA | C49H75N7O15 |
| MOLECULAR WEIGHT (Da) | 1002.1730 |
| ACCURATE MASS (Da) | 1001.5321 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Burkholderia |
| ORIGIN SPECIES | crenata |
| InChIKey | IMXKHFILKMPFGB-DIFJVPAQSA-N |
| InChI | InChI=1S/C49H75N7O15/c1-17-34(58)52-35(39(59)24(2)3)47(65)70-40(25(4)5)36-46(64)56(15)38(30(11)68-16)49(67)71-41(26(6)7)37(51-31(12)57)48(66)69-33(23-32-21-19-18-20-22-32)45(63)55(14)28(9)42(60)50-27(8)44(62)54(13)29(10)43(61)53-36/h18-22,24-27,29-30,33,35-41,59H,9,17,23H2,1-8,10-16H3,(H,50,60)(H,51,57)(H,52,58)(H,53,61)/t27-,29-,30+,33+,35-,36-,37+,38-,39+,40+,41+/m0/s1 |
| SMILES | C=C1C(=O)N[C@@H](C)C(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@H](OC(=O)[C@@H](NC(=O)CC)[C@H](O)C(C)C)C(C)C)C(=O)N(C)[C@@H]([C@@H](C)OC)C(=O)O[C@H](C(C)C)[C@@H](NC(C)=O)C(=O)O[C@H](CC2=CC=CC=C2)C(=O)N1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Crüsemann M; Reher R; Schamari I; Brachmann AO; Ohbayashi T; Kuschak M; Malfacini D; Seidinger A; Pinto-Carbó M; Richarz R; Reuter T; Kehraus S; Hallab A; Attwood M; Schiöth HB; Mergaert P; Kikuchi Y; Schäberle TF; Kostenis E; Wenzel D; Müller CE; Piel J; Carlier A; Eberl L; König GM Heterologous Expression, Biosynthetic Studies, and Ecological Function of the Selective Gq-Signaling Inhibitor FR900359 Angewandte Chemie International Edition 2018 57 (3) 836-840. | ||
|---|---|---|---|
| DOI | 10.1002/anie.201707996 | PMID | 29194875 |
