Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022093
PROPERTIES
| NPAID | NPA022093 |
|---|---|
| CLUSTER ID | 6821 |
| NODE ID | 4715 |
| NAME | Micromonohalimane B |
| FORMULA | C22H33ClO5 |
| MOLECULAR WEIGHT (Da) | 412.9540 |
| ACCURATE MASS (Da) | 412.2017 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Micromonospora |
| ORIGIN SPECIES | sp. |
| InChIKey | VHRXKVWBDALPTK-SBPFZVHCSA-N |
| InChI | InChI=1S/C22H33ClO5/c1-13-8-9-15-16(7-6-10-20(15,3)4)21(13,5)11-17-22(26,12-23)18(19(25)28-17)27-14(2)24/h9,13,16-18,26H,6-8,10-12H2,1-5H3/t13-,16+,17+,18-,21+,22+/m1/s1 |
| SMILES | C[C@@H]1CC=C2[C@@H]([C@@]1(C)C[C@H]3[C@]([C@@H](C(=O)O3)OC(=O)C)(CCl)O)CCCC2(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Yan; Adnani, Navid; Braun, Doug R.; Ellis, Gregory A.; Barns, Kenneth J.; Parker-Nance, Shirley; Guzei, Ilia A.; Bugni, Tim S. Micromonohalimanes A and B: Antibacterial Halimane-Type Diterpenoids from a Marine Micromonospora Species Journal of Natural Products 2016 79 (11) 2968-2972. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00555 | PMID | 27813411 |
