Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013844
PROPERTIES
| NPAID | NPA013844 |
|---|---|
| CLUSTER ID | 4329 |
| NODE ID | 1080 |
| NAME | Hamigeran L 11-O-methyl ester |
| FORMULA | C20H27BrO5 |
| MOLECULAR WEIGHT (Da) | 427.3350 |
| ACCURATE MASS (Da) | 426.1042 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hamigera |
| ORIGIN SPECIES | tarangaensis |
| InChIKey | PFHVKHJUCDAVBU-RRBXVBTKSA-N |
| InChI | InChI=1S/C20H27BrO5/c1-10(2)12-6-7-20(4,9-14(22)26-5)16(12)13-8-11(3)17(21)18(23)15(13)19(24)25/h8,10,12,16,23H,6-7,9H2,1-5H3,(H,24,25)/t12-,16-,20+/m1/s1 |
| SMILES | CC1=C(C(=C(C(=C1)[C@H]2[C@H](CC[C@@]2(C)CC(=O)OC)C(C)C)C(=O)O)O)Br |
ORIGINAL ISOLATION REFERENCE
| CITATION | Singh, A Jonathan; Dattelbaum, Jonathan D; Field, Jessica J; Smart, Zlatka; Woolly, Ethan F; Barber, Jacqueline M; Heathcott, Rosemary; Miller, John H; Northcote, Peter T Structurally diverse hamigerans from the New Zealand marine sponge Hamigera tarangaensis: NMR-directed isolation, structure elucidation and antifungal activity Organic & Biomolecular Chemistry 2013 11 (46) 8041-8051. | ||
|---|---|---|---|
| DOI | 10.1039/c3ob41305e | PMID | 23925673 |
