Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008766
PROPERTIES
NPAID | NPA008766 |
---|---|
CLUSTER ID | 77 |
NODE ID | 72 |
NAME | Agariblazeispirol A |
FORMULA | C25H34O4 |
MOLECULAR WEIGHT (Da) | 398.5430 |
ACCURATE MASS (Da) | 398.2457 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Agaricus |
ORIGIN SPECIES | blazei |
InChIKey | XANOSTKMMIEIMI-XJOOGWOKSA-N |
InChI | InChI=1S/C25H34O4/c1-14-17-10-13-24-18(11-12-23(24,6)19(17)8-9-20(14)27-7)15(2)25(29-24)21(26)16(3)22(4,5)28-25/h8-10,13,15-16,18,21,26H,11-12H2,1-7H3/t15-,16-,18+,21+,23+,24-,25+/m0/s1 |
SMILES | C[C@H]1[C@H]2CC[C@]3([C@@]2(C=CC4=C3C=CC(=C4C)OC)O[C@@]15[C@@H]([C@@H](C(O5)(C)C)C)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Hirotani, Masao; Hirotani, Seiko; Takayanagi, Hiroaki; Komiyama, Kanki; Yoshikawa, Takafumi Agariblazeispirols A and B, an unprecedented skeleton from the cultured mycelia of the fungus, Agaricus blazei Tetrahedron Letters 2003 44 (43) 7975-7979. | ||
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DOI | 10.1016/j.tetlet.2003.08.111 | PMID | - |