Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004854
PROPERTIES
| NPAID | NPA004854 |
|---|---|
| CLUSTER ID | 95 |
| NODE ID | 90 |
| NAME | Sesquicillin |
| FORMULA | C29H42O5 |
| MOLECULAR WEIGHT (Da) | 470.6500 |
| ACCURATE MASS (Da) | 470.3032 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Albophoma |
| ORIGIN SPECIES | sp. FKI-1778 |
| InChIKey | XYRWDMXUDDAXMF-JJPZVYOZSA-N |
| InChI | InChI=1S/C29H42O5/c1-17(2)10-9-14-29(8)24-12-11-18(3)23(28(24,7)15-13-25(29)34-21(6)30)16-22-26(31)19(4)20(5)33-27(22)32/h10,23-25,31H,3,9,11-16H2,1-2,4-8H3/t23-,24-,25+,28-,29+/m1/s1 |
| SMILES | CC1=C(OC(=O)C(=C1O)C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@@H]([C@@]3(C)CCC=C(C)C)OC(=O)C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Engel, L; Erkel, G; Anke, T; Sterner, O Sesquicillin, an inhibitor of glucocorticoid mediated signal transduction Journal of Antibiotics 1998 51 (5) 518-521. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.51.518 | PMID | 9666183 |
SYNTHESES
| CITATION 1 | Zhang F; Danishefsky SJ An efficient stereoselective total synthesis of DL-sesquicillin, a glucocorticoid antagonist. Angewandte Chemie International Edition 2002 41 (8) 1434-7. DOI: 10.1002/1521-3773(20020415)41:8<1434::aid-anie1434>3.0.co;2-a PMID: 19750790 | ||
|---|---|---|---|
