Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA004940
PROPERTIES
NPAID | NPA004940 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | Hypsiziprenol-A14 |
FORMULA | C70H136O12 |
MOLECULAR WEIGHT (Da) | 1169.8460 |
ACCURATE MASS (Da) | 1169.0032 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hypsizygus |
ORIGIN SPECIES | marmoreus |
InChIKey | VQYRCJJCNPRIPS-MHMNSPPKSA-N |
InChI | InChI=1S/C70H136O12/c1-17-59(5,71)34-19-32-58(4)33-20-36-61(7,73)38-22-40-63(9,75)42-24-44-65(11,77)46-26-48-67(13,79)50-28-52-69(15,81)54-30-56-70(16,82)55-29-53-68(14,80)51-27-49-66(12,78)47-25-45-64(10,76)43-23-41-62(8,74)39-21-37-60(6,72)35-18-31-57(2)3/h17,31-32,71-82H,1,18-30,33-56H2,2-16H3/b58-32+ |
SMILES | CC(=CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(CCCC(C)(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)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 |