Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024410
PROPERTIES
| NPAID | NPA024410 |
|---|---|
| CLUSTER ID | 7462 |
| NODE ID | 721 |
| NAME | Bonnadiene |
| FORMULA | C21H34 |
| MOLECULAR WEIGHT (Da) | 286.5030 |
| ACCURATE MASS (Da) | 286.2661 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Allokutzneria |
| ORIGIN SPECIES | albata |
| InChIKey | ODFAUAJALPIDBF-LMNJBCLMSA-N |
| InChI | InChI=1S/C21H34/c1-14(2)17-8-7-16(4)18-10-11-20(5,6)21(18)12-9-15(3)13-19(17)21/h13-14,17,19H,7-12H2,1-6H3/t17-,19+,21+/m1/s1 |
| SMILES | CC1=C[C@H]2[C@H](CCC(=C3[C@]2(CC1)C(CC3)(C)C)C)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lauterbach, Lukas; Rinkel, Jan; Dickschat, Jeroen S. Two Bacterial Diterpene Synthases from Allokutzneria albata Produce Bonnadiene, Phomopsene, and Allokutznerene Angewandte Chemie International Edition 2018 57 (27) 8280-8283. | ||
|---|---|---|---|
| DOI | 10.1002/anie.201803800 | PMID | 29758116 |
