Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA002983
PROPERTIES
NPAID | NPA002983 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | Hypsiziprenol-BA10 |
FORMULA | C50H94O8 |
MOLECULAR WEIGHT (Da) | 823.2940 |
ACCURATE MASS (Da) | 822.6949 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hypsizygus |
ORIGIN SPECIES | marmoreus |
InChIKey | SAOYPUOWYBAYST-MHKLCUJQSA-N |
InChI | InChI=1S/C50H94O8/c1-13-44(6,52)28-16-25-41(4)23-14-24-42(5)26-27-43(51)50(12,58)39-21-38-49(11,57)37-20-36-48(10,56)35-19-34-47(9,55)33-18-32-46(8,54)31-17-30-45(7,53)29-15-22-40(2)3/h13,22,24-25,43,51-58H,1,14-21,23,26-39H2,2-12H3/b41-25+,42-24+ |
SMILES | CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(C(CC/C(=C/CC/C(=C/CCC(C)(C=C)O)/C)/C)O)O)O)O)O)O)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Sawabe, A; Morita, M; Kiso, T; Kishine, H; Ohtsubo, Y; Ouchi, S; Okamoto, T Structural analyses of a precursory substance of bitterness: new polyisoprenepolyols isolated from an edible mushroom (Hypsizigusmarmoreus) by fast atom bombardment mass spectrometry Journal of Agricultural and Food Chemistry 1999 47 (2) 588-593. | ||
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DOI | 10.1021/jf980843y | PMID | 10563937 |