Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005088
PROPERTIES
| NPAID | NPA005088 |
|---|---|
| CLUSTER ID | 912 |
| NODE ID | 754 |
| NAME | Polyporusterone B |
| FORMULA | C28H44O6 |
| MOLECULAR WEIGHT (Da) | 476.6540 |
| ACCURATE MASS (Da) | 476.3138 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Polyporus |
| ORIGIN SPECIES | umbellatus |
| InChIKey | OQDKHYZVFZGSRC-HOZHHLCUSA-N |
| InChI | InChI=1S/C28H44O6/c1-15(2)16(3)11-24(32)27(6,33)23-8-10-28(34)18-12-20(29)19-13-21(30)22(31)14-25(19,4)17(18)7-9-26(23,28)5/h12,15,17,19,21-24,30-34H,3,7-11,13-14H2,1-2,4-6H3/t17-,19-,21+,22-,23?,24+,25+,26+,27?,28+/m0/s1 |
| SMILES | CC(C)C(=C)C[C@H](C(C)(C1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sun, Yi; Yasukawa, Ken New anti-inflammatory ergostane-type ecdysteroids from the sclerotium of Polyporus umbellatus Bioorganic and Medicinal Chemistry Letters 2008 18 (11) 3417-3420. | ||
|---|---|---|---|
| DOI | 10.1016/j.bmcl.2008.04.008 | PMID | 18439824 |
