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Chem
J-GLOBAL ID：200907006836233660
Nikkaji number：J2.742.538K Prephytoene diphosphate
プレフィテンジホスファート
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
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
Molecular formula： C40H68O7P2
Molecular formula furigana： C40-H68-O7-P2
Molecular weight： 722.925
InChI：
InChI=1S/C40H68O7P2/c1-31(2)17-11-19-33(5)21-13-23-35(7)25-15-26-37(9)29-38-39(30-46-49(44,45)47-48(41,42)43)40(38,10)28-16-27-36(8)24-14-22-34(6)20-12-18-32(3)4/h17-18,21-22,25,27,29,38-39H,11-16,19-20,23-24,26,28,30H2,1-10H3,(H,44,45)(H2,41,42,43)/t38-,39-,40-/m1/s1
InChI key：
RVCNKTPCHZNAAO-ACUYYCNJSA-N
SMILES：
CC(=CCCC(=CCCC(=CCCC(=C[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)O)[C@]1(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C)C
Systematic name (3)： - 二りん酸α-[[(1R)-2-メチル-2α-(4,8,12-トリメチル-3,7,11-トリデカトリエニル)-3α-(2,6,10,14-テトラメチル-1,5,9,13-ペンタデカテトラエニル)シクロプロピル]メチル]
- {[ヒドロキシ({[(1R,2R,3R)-2-メチル-3-(2,6,10,14-テトラメチルペンタデカ-1,5,9,13-テトラエン-1-イル)-2-(4,8,12-トリメチルトリデカ-3,7,11-トリエン-1-イル)シクロプロピル]メトキシ})ホスホリル]オキシ}ホスホン酸
- {[hydroxy({[(1R,2R,3R)-2-methyl-3-(2,6,10,14-tetramethylpentadeca-1,5,9,13-tetraen-1-yl)-2-(4,8,12-trimethyltrideca-3,7,11-trien-1-yl)cyclopropyl]methoxy})phosphoryl]oxy}phosphonic acid
- Diphosphoric acid α-[[(1R)-2-methyl-2α-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-3α-(2,6,10,14-tetramethyl-1,5,9,13-pentadecatetraenyl)cyclopropyl]methyl] ester
- Prephytoene diphosphate
- プレフィテンジホスファート
KEGG COMPOUND： C03427
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