Chem
J-GLOBAL ID:200907041731332981
Nikkaji number:J2.297.350I
Diphosphoric acid α-(5,7-dihydroxy-7-methyl-9-oxo-9-oxylatononyl)β-[(2E)-3,7-dimethyl-2,6-octadienyl] ester
二りん酸α-(5,7-ジヒドロキシ-7-メチル-9-オキソ-9-オキシラトノニル)β-[(2E)-3,7-ジメチル-2,6-オクタジエニル]
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H37 O10 [O-]P2
Molecular formula furigana:
C20-H37-O11-P2
Molecular weight:
515.453
InChI:
InChI=1S/C20H38O11P2/c1-16(2)8-7-9-17(3)11-13-30-33(27,28)31-32(25,26)29-12-6-5-10-18(21)14-20(4,24)15-19(22)23/h8,11,18,21,24H,5-7,9-10,12-15H2,1-4H3,(H,22,23)(H,25,26)(H,27,28)/p-1/b17-11+
InChI key:
PMUQIJKCGIYWGT-GZTJUZNOSA-M
SMILES:
CC(=CCC/C(=C/COP(=O)(O)OP(=O)(O)OCCCCC(O)CC(C)(O)CC(=O)[O-])/C)C
Systematic name (3):
二りん酸α-(5,7-ジヒドロキシ-7-メチル-9-オキソ-9-オキシラトノニル)β-[(2E)-3,7-ジメチル-2,6-オクタジエニル]
9-({[({[(2E)-3,7-ジメチルオクタ-2,6-ジエン-1-イル]オキシ}(ヒドロキシ)ホスホリル)オキシ](ヒドロキシ)ホスホリル}オキシ)-3,5-ジヒドロキシ-3-メチルノナノアート
9-({[({[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3,5-dihydroxy-3-methylnonanoate
Other name (1):
Diphosphoric acid α-(5,7-dihydroxy-7-methyl-9-oxo-9-oxylatononyl)β-[(2E)-3,7-dimethyl-2,6-octadienyl] ester
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