Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008857
PROPERTIES
NPAID | NPA008857 |
---|---|
CLUSTER ID | 912 |
NODE ID | 754 |
NAME | Polyporoid C |
FORMULA | C28H46O7 |
MOLECULAR WEIGHT (Da) | 494.6690 |
ACCURATE MASS (Da) | 494.3244 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Polyporus |
ORIGIN SPECIES | umbellatus |
InChIKey | RVRAYMBCPTYQKZ-UFOPSCFWSA-N |
InChI | InChI=1S/C28H46O7/c1-14(2)15(3)9-23(33)27(6,34)24-22(32)13-28(35)17-10-19(29)18-11-20(30)21(31)12-25(18,4)16(17)7-8-26(24,28)5/h10,14-16,18,20-24,30-35H,7-9,11-13H2,1-6H3/t15?,16-,18-,20+,21-,22-,23+,24-,25+,26+,27-,28+/m0/s1 |
SMILES | CC(C)C(C)C[C@H]([C@@](C)([C@H]1[C@H](C[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)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. | ||
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DOI | 10.1016/j.bmcl.2008.04.008 | PMID | 18439824 |