Chem
J-GLOBAL ID:200907029724343021
Nikkaji number:J1.396.662A
(2E,6E,10E)-3,7,11,15-Tetramethyl(3,6-13 C2 )hexadecane-2,6,10,14-tetrene-1-ol diphosphoric acid
(2E,6E,10E)-3,7,11,15-テトラメチル(3,6-13 C2 )ヘキサデカン-2,6,10,14-テトラエン-1-オール二りん酸
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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:
C18 [13 C]2 H36 O7 P2
Molecular formula furigana:
C20-H36-O7-P2
Molecular weight:
452.433
InChI:
InChI=1S/C20H36O7P2/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-26-29(24,25)27-28(21,22)23/h9,11,13,15H,6-8,10,12,14,16H2,1-5H3,(H,24,25)(H2,21,22,23)/b18-11+,19-13+,20-15+/i13+1,20+1
InChI key:
OINNEUNVOZHBOX-TZIMCYQNSA-N
SMILES:
CC(=CCC/C(=C/CC/C(=[13CH]/CC/[13C](=C/COP(=O)(O)OP(=O)(O)O)/C)/C)/C)C
Systematic name (3):
(2E,6E,10E)-3,7,11,15-テトラメチル(3,6-13 C2 )ヘキサデカン-2,6,10,14-テトラエン-1-オール二りん酸
{[ヒドロキシ({[(2E,6E,10E)-3,7,11,15-テトラメチル(3,6-13 C2 )ヘキサデカ-2,6,10,14-テトラエン-1-イル]オキシ})ホスホリル]オキシ}ホスホン酸
{[hydroxy({[(2E,6E,10E)-3,7,11,15-tetramethyl(3,6-13 C2 )hexadeca-2,6,10,14-tetraen-1-yl]oxy})phosphoryl]oxy}phosphonic acid
Other name (1):
(2E,6E,10E)-3,7,11,15-Tetramethyl(3,6-13 C2 )hexadecane-2,6,10,14-tetrene-1-ol diphosphoric acid
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