Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000007104 | Gold | 3 |
| CCMSLIB00000007105 | Gold | 3 |
| CCMSLIB00000007106 | Gold | 3 |
| CCMSLIB00000007107 | Gold | 3 |
| CCMSLIB00000007108 | Gold | 3 |
COMPOUND NPA028635
PROPERTIES
| NPAID | NPA028635 |
|---|---|
| CLUSTER ID | 8570 |
| NODE ID | 4478 |
| NAME | Mycalamide A |
| FORMULA | C24H41NO10 |
| MOLECULAR WEIGHT (Da) | 503.5890 |
| ACCURATE MASS (Da) | 503.2730 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Entotheonella |
| ORIGIN SPECIES | ignis |
| InChIKey | IJASURGZDJYQGF-UBZSBTAVSA-N |
| InChI | InChI=1S/C24H41NO10/c1-12-9-24(31-7,35-14(3)13(12)2)19(28)21(29)25-22-18-17(32-11-33-22)20(30-6)23(4,5)16(34-18)8-15(27)10-26/h13-20,22,26-28H,1,8-11H2,2-7H3,(H,25,29)/t13-,14-,15?,16-,17+,18+,19-,20-,22?,24-/m1/s1 |
| SMILES | C=C1C[C@](OC)([C@H](O)C(=O)NC2OCO[C@H]3[C@@H]2O[C@H](CC(O)CO)C(C)(C)[C@@H]3OC)O[C@H](C)[C@@H]1C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Rust M; Helfrich EJN; Freeman MF; Nanudorn P; Field CM; Rückert C; Kündig T; Page MJ; Webb VL; Kalinowski J; Sunagawa S; Piel J A multiproducer microbiome generates chemical diversity in the marine sponge Mycale hentscheli. Proceedings of the National Academy of Sciences of the United States of America 2020 117 (17) 9508-9518. | ||
|---|---|---|---|
| DOI | 10.1073/pnas.1919245117 | PMID | 32291345 |
