Chem
J-GLOBAL ID：201407014278060382
Nikkaji number：J3.252.009J
Uridine 5′-diphosphoric acid P2-[3α-(acetylamino)-4β,5α-dihydroxy-6β-(hydroxymethyl)tetrahydro-2H-thiopyran-2α-yl] ester
ウリジン5′-二りん酸P2-[3α-(アセチルアミノ)-4β,5α-ジヒドロキシ-6β-(ヒドロキシメチル)テトラヒドロ-2H-チオピラン-2α-イル]
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： C17H27N3O16P2S
Molecular formula furigana： C17-H27-N3-O16-P2-S
Molecular weight： 623.420
InChI：
InChI=1S/C17H27N3O16P2S/c1-6(22)18-10-13(26)12(25)8(4-21)39-16(10)35-38(31,32)36-37(29,30)33-5-7-11(24)14(27)15(34-7)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10-,11-,12-,13-,14-,15-,16+/m1/s1
InChI key：
JPRVHSQHWXZSNC-UBDZBXRQSA-N
SMILES：
CC(=O)N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)S[C@H](CO)[C@@H](O)[C@@H]1O
Systematic name (3)：
- ウリジン5′-二りん酸P2-[3α-(アセチルアミノ)-4β,5α-ジヒドロキシ-6β-(ヒドロキシメチル)テトラヒドロ-2H-チオピラン-2α-イル]
- {[(2R,3S,4R,5R)-5-(2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)-3,4-ジヒドロキシオキソラン-2-イル]メトキシ}[({[(2S,3R,4R,5S,6R)-3-アセトアミド-4,5-ジヒドロキシ-6-(ヒドロキシメチル)チアン-2-イル]オキシ}(ヒドロキシ)ホスホリル)オキシ]ホスフィン酸
- {[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}[({[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)thian-2-yl]oxy}(hydroxy)phosphoryl)oxy]phosphinic acid
- Uridine 5′-diphosphoric acid P2-[3α-(acetylamino)-4β,5α-dihydroxy-6β-(hydroxymethyl)tetrahydro-2H-thiopyran-2α-yl] ester
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