Chem
J-GLOBAL ID：201007062753311960   Nikkaji number：J2.806.268K

CDP-4-dehydro-3,6-dideoxy-D-glucose epimer

シチジン5′-二りん酸β-[(2R)-3α-ヒドロキシ-3,4,5,6-テトラヒドロ-6α-メチル-5-オキソ2H-ピラン-2α-イル]
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： C15H23N3O14P2
Molecular formula furigana： C15-H23-N3-O14-P2
Molecular weight： 531.304
InChI： InChI=1S/C15H23N3O14P2/c1-6-7(19)4-8(20)14(29-6)31-34(26,27)32-33(24,25)28-5-9-11(21)12(22)13(30-9)18-3-2-10(16)17-15(18)23/h2-3,6,8-9,11-14,20-22H,4-5H2,1H3,(H,24,25)(H,26,27)(H2,16,17,23)/t6-,8+,9+,11+,12+,13+,14+/m0/s1
InChI key： DATWFRMXXZBEPM-SGLIKCFUSA-N
SMILES： C[C@@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(N)nc2=O)[C@H](O)CC1=O
Systematic name  (3)：
  • シチジン5′-二りん酸β-[(2R)-3α-ヒドロキシ-3,4,5,6-テトラヒドロ-6α-メチル-5-オキソ2H-ピラン-2α-イル]
  • {[(2R,3S,4R,5R)-5-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-3,4-ジヒドロキシオキソラン-2-イル]メトキシ}({[ヒドロキシ({[(2R,3R,6S)-3-ヒドロキシ-6-メチル-5-オキソオキサン-2-イル]オキシ})ホスホリル]オキシ})ホスフィン酸
  • {[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[hydroxy({[(2R,3R,6S)-3-hydroxy-6-methyl-5-oxooxan-2-yl]oxy})phosphoryl]oxy})phosphinic acid
Other name (2)：
  • Cytidine 5′-diphosphoric acid β-[(2R)-3α-hydroxy-3,4,5,6-tetrahydro-6α-methyl-5-oxo 2H-pyran-2α-yl] ester
  • CDP-4-dehydro-3,6-dideoxy-D-glucose epimer
KEGG COMPOUND： C17326
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