Chem
J-GLOBAL ID:200907033873676278
Nikkaji number:J1.895.110J
TDP-L-Noviose
TDP-L-ノビオース
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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:
C17 H28 N2 O15 P2
Molecular formula furigana:
C17-H28-N2-O15-P2
Molecular weight:
562.358
InChI:
InChI=1S/C17H28N2O15P2/c1-7-5-19(16(25)18-14(7)24)10-4-8(20)9(31-10)6-30-35(26,27)34-36(28,29)33-15-12(22)11(21)13(23)17(2,3)32-15/h5,8-13,15,20-23H,4,6H2,1-3H3,(H,26,27)(H,28,29)(H,18,24,25)/t8-,9+,10+,11-,12+,13+,15+/m0/s1
InChI key:
DVDRTBMEUQUIJJ-FNTRQBMGSA-N
SMILES:
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3OC(C)(C)[C@H](O)[C@@H](O)[C@H]3O)O2)c(=O)[nH]c1=O
Systematic name (5):
チミジン5′-二りん酸β-(5-メチル-6-デオキシ-α-D-グロピラノシル)
チミジン5′-[二りん酸P2 -[(2R)-3α,4α,5β-トリヒドロキシ-6,6-ジメチルテトラヒドロ-2H-ピラン-2α-イル]]
チミジン5′-二りん酸β-(5,5-ジメチル-β-L-リキソピラノシル)
{[ヒドロキシ({[(2R,3R,4R,5R)-3,4,5-トリヒドロキシ-6,6-ジメチルオキサン-2-イル]オキシ})ホスホリル]オキシ}({[(2R,3S,5R)-3-ヒドロキシ-5-(5-メチル-2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)オキソラン-2-イル]メトキシ})ホスフィン酸
{[hydroxy({[(2R,3R,4R,5R)-3,4,5-trihydroxy-6,6-dimethyloxan-2-yl]oxy})phosphoryl]oxy}({[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphinic acid
Other name (7):
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