Chem
J-GLOBAL ID:200907042842333290   Nikkaji number:J2.760.893K

dTDP-4-acetamido-4,6-dideoxy-D-glucose

チミジン5′-二りん酸β-[4-(アセチルアミノ)-4,6-ジデオキシ-α-D-グルコピラノシル]
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: C18H29N3O15P2
Molecular formula furigana: C18-H29-N3-O15-P2
Molecular weight: 589.384
InChI: InChI=1S/C18H29N3O15P2/c1-7-5-21(18(27)20-16(7)26)12-4-10(23)11(34-12)6-32-37(28,29)36-38(30,31)35-17-15(25)14(24)13(8(2)33-17)19-9(3)22/h5,8,10-15,17,23-25H,4,6H2,1-3H3,(H,19,22)(H,28,29)(H,30,31)(H,20,26,27)/t8-,10+,11-,12-,13-,14+,15-,17-/m1/s1
InChI key: YHXQWYBLXUELDA-XGEGERJZSA-N
SMILES: C[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@H](C[C@@H]2O)n2cc(C)c(=O)[nH]c2=O)[C@H](O)[C@@H](O)[C@@H]1NC(=O)C
Systematic name  (3):
  • チミジン5′-二りん酸β-[4-(アセチルアミノ)-4,6-ジデオキシ-α-D-グルコピラノシル]
  • [({[(2R,3R,4S,5S,6R)-5-アセトアミド-3,4-ジヒドロキシ-6-メチルオキサン-2-イル]オキシ}(ヒドロキシ)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
  • [({[(2R,3R,4S,5S,6R)-5-acetamido-3,4-dihydroxy-6-methyloxan-2-yl]oxy}(hydroxy)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 (2):
  • Thymidine 5′-diphosphoric acid β-[4-(acetylamino)-4,6-dideoxy-α-D-glucopyranosyl] ester
  • dTDP-4-acetamido-4,6-dideoxy-D-glucose
KEGG COMPOUND: C06018
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