Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000525
PROPERTIES
| NPAID | NPA000525 |
|---|---|
| CLUSTER ID | 172 |
| NODE ID | 161 |
| NAME | Demethylasterriquinone B1 |
| FORMULA | C32H30N2O4 |
| MOLECULAR WEIGHT (Da) | 506.6020 |
| ACCURATE MASS (Da) | 506.2206 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Pseudomassaria |
| ORIGIN SPECIES | sp. |
| InChIKey | XMGNJVXBPZAETK-UHFFFAOYSA-N |
| InChI | InChI=1S/C32H30N2O4/c1-6-32(4,5)31-23(20-11-7-8-13-22(20)34-31)25-29(37)27(35)24(28(36)30(25)38)21-16-33-26-18(15-14-17(2)3)10-9-12-19(21)26/h6-14,16,33-35,38H,1,15H2,2-5H3 |
| SMILES | CC(=CCC1=CC=CC2=C1NC=C2C3=C(C(=O)C(=C(C3=O)O)C4=C(NC5=CC=CC=C54)C(C)(C)C=C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, B. Discovery of a Small Molecule Insulin Mimetic with Antidiabetic Activity in Mice Science 1999 284 (5416) 974-977. | ||
|---|---|---|---|
| DOI | 10.1126/science.284.5416.974 | PMID | 10320380 |
SYNTHESES
| CITATION 1 | Pirrung MC; Liu Y; Deng L; Halstead DK; Li Z; May JF; Wedel M; Austin DA; Webster NJ Methyl scanning: total synthesis of demethylasterriquinone B1 and derivatives for identification of sites of interaction with and isolation of its receptor(s). Journal of the American Chemical Society 2005 127 (13) 4609-24. DOI: 10.1021/ja044325h PMID: 15796526 | ||
|---|---|---|---|
