Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA002107
PROPERTIES
NPAID | NPA002107 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | Hypsiziprenol-A9 |
FORMULA | C45H86O7 |
MOLECULAR WEIGHT (Da) | 739.1760 |
ACCURATE MASS (Da) | 738.6374 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hypsizygus |
ORIGIN SPECIES | marmoreus |
InChIKey | RBDIOUBPOLHFMP-NNLKUIAGSA-N |
InChI | InChI=1S/C45H86O7/c1-12-39(5,46)24-14-22-38(4)23-15-26-41(7,48)28-17-30-43(9,50)32-19-34-45(11,52)36-20-35-44(10,51)33-18-31-42(8,49)29-16-27-40(6,47)25-13-21-37(2)3/h12,21-22,46-52H,1,13-20,23-36H2,2-11H3/b38-22+ |
SMILES | CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCC/C(=C/CCC(C)(C=C)O)/C)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 |