Chem
J-GLOBAL ID:200907016679613107   Nikkaji number:J1.083.748K

3′α-(Carboxymethyl)-5′-(4,4′-dimethoxytritylamino)-3′,5′-dideoxythymidine

3′α-(カルボキシメチル)-5′-(4,4′-ジメトキシトリチルアミノ)-3′,5′-ジデオキシチミジン
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: C33H35N3O7
Molecular formula furigana: C33-H35-N3-O7
Molecular weight: 585.657
InChI: InChI=1S/C33H35N3O7/c1-21-20-36(32(40)35-31(21)39)29-17-22(18-30(37)38)28(43-29)19-34-33(23-7-5-4-6-8-23,24-9-13-26(41-2)14-10-24)25-11-15-27(42-3)16-12-25/h4-16,20,22,28-29,34H,17-19H2,1-3H3,(H,37,38)(H,35,39,40)/t22-,28-,29-/m1/s1
InChI key: XNFWIIQFIJFBNH-RNOQYBQRSA-N
SMILES: COc1ccc(cc1)C(NC[C@H]1O[C@H](C[C@@H]1CC(=O)O)n1cc(C)c(=O)[nH]c1=O)(c1ccccc1)c1ccc(OC)cc1
Systematic name  (3):
  • 3′α-(カルボキシメチル)-5′-(4,4′-ジメトキシトリチルアミノ)-3′,5′-ジデオキシチミジン
  • 2-[(2S,3R,5R)-2-({[ビス(4-メトキシフェニル)(フェニル)メチル]アミノ}メチル)-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-3-イル]酢酸
  • 2-[(2S,3R,5R)-2-({[bis(4-methoxyphenyl)(phenyl)methyl]amino}methyl)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl]acetic acid
Other name (1):
  • 3′α-(Carboxymethyl)-5′-(4,4′-dimethoxytritylamino)-3′,5′-dideoxythymidine
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