Chem
J-GLOBAL ID:200907089303433059
Nikkaji number:J1.447.456K
Diphosphoric acid P1 -[(2E,6E,10E)-3,7-dimethyl-11-(2 H3 )methyl-2,6,10-dodecatrienyl] ester
二りん酸P1 -[(2E,6E,10E)-3,7-ジメチル-11-(2 H3 )メチル-2,6,10-ドデカトリエニル]
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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:
C15 H25 [2 H]3 O7 P2
Molecular formula furigana:
C15-H28-O7-P2
Molecular weight:
385.348
InChI:
InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+/i1D3/b13-7-,14-9+,15-11+
InChI key:
VWFJDQUYCIWHTN-KQCZJJFRSA-N
SMILES:
C([2H])([2H])([2H])/C(=C/CC/C(=C/CC/C(=C/COP(=O)(O)OP(=O)(O)O)/C)/C)/C
Systematic name (3):
二りん酸P1 -[(2E,6E,10E)-3,7-ジメチル-11-(2 H3 )メチル-2,6,10-ドデカトリエニル]
{[ヒドロキシ({[(2E,6E,10E)-3,7,11-トリメチル(12,12,12-2 H3 )ドデカ-2,6,10-トリエン-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-trimethyl(12,12,12-2 H3 )dodeca-2,6,10-trien-1-yl]oxy})phosphoryl]oxy}phosphonic acid
Other name (1):
Diphosphoric acid P1 -[(2E,6E,10E)-3,7-dimethyl-11-(2 H3 )methyl-2,6,10-dodecatrienyl] ester
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