Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA016073
PROPERTIES
| NPAID | NPA016073 |
|---|---|
| CLUSTER ID | 5535 |
| NODE ID | 424 |
| NAME | BE-40644 |
| FORMULA | C22H30O4 |
| MOLECULAR WEIGHT (Da) | 358.4780 |
| ACCURATE MASS (Da) | 358.2144 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinoplanes |
| ORIGIN SPECIES | sp. A40644 |
| InChIKey | JJCFWPNMYFMHEH-WOSNLTMFSA-N |
| InChI | InChI=1S/C22H30O4/c1-20(2)7-5-8-21(3)16(20)6-9-22(4)17(21)11-14-15(24)10-13(12-23)18(25)19(14)26-22/h10,16-17,23H,5-9,11-12H2,1-4H3/t16-,17+,21-,22-/m1/s1 |
| SMILES | C[C@@]12CCCC([C@H]1CC[C@@]3([C@H]2CC4=C(O3)C(=O)C(=CC4=O)CO)C)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | TORIGOE, KOICHIRO; WAKASUGI, NAOMI; SAKAIZUMI, NAMI; IKEJIMA, TAKASHI; SUZUKI, HAJIME; KOJIRI, KATSUHISA; SUDA, HIROYUKI BE40644, a New Human Thioredoxin System Inhibitor Isolated from Actinoplanes sp. A40644 Journal of Antibiotics 1996 49 (3) 314-317. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.49.314 | PMID | 8626250 |
