(2R,3S,4R,5R)-5-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-2-({[{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1(2H)-pyrimidinyl)-2-({[{[(2R,3S,4R,5R)-2-({[{[(2R,3S,4R,5R)-2-({[{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1(2H)-pyrimid inyl)-4-hydroxy-2-(hydroxymethyl)tetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-puri n-9-yl)-4-hydroxytetrahydro-3-furanyl]oxy}(h

More details:

• Systematic name

  (2R,3S,4R,5R)-5-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-2-({[{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1(2H)-pyrimidinyl)-2-({[{[(2R,3S,4R,5R)-2-({[{[(2R,3S,4R,5R)-2-({[{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1(2H)-pyrimid inyl)-4-hydroxy-2-(hydroxymethyl)tetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxytetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-puri n-9-yl)-4-hydroxytetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-4-hydroxytetrahydro-3-furanyl]oxy}(hydroxy)phosphoryl]oxy}methyl)-4-hydroxytetrahydro-3-furanyl {(2S,3S,4R,5R)-5-(6-amino-9H-p urin-9-yl)-3-[(2-formamido-5-sulfanylpentanoyl)amino]-4-hydroxytetrahydro-2-furanyl}methyl hydrogen phosphate

• SMILES

  O=P(O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(=O)(O[C@@H]3[C@H](O[C@@H](N2/C=C\C(=N/C2=O)\N)[C@@H]3O)CO)O)n4c5ncnc(N)c5nc4)(O)OC[C@H]%15O[C@@H](n6c7ncnc(N)c7nc6)[C@H](O)[C@@H]%15OP(=O)(O)OC[C@H]%14O[C@@H](N8/C=C\C(=N/C8=O)\N)[C@H](O)[C@@H]%14OP(=O)(O)OC[C@H]%13O[C@@H](N/9C(=O)/N=C(/N)\C=C\9)[C@H](O)[C@@H]%13OP(=O)(O)OC[C@H]%12O[C@@H](n%10c%11ncnc(N)c%11nc%10)[C@H](O)[C@@H]%12NC(=O)C(NC=O)CCCS

• Std. InChi

  InChI=1S/C63H83N26O38P5S/c64-30-3-6-84(61(99)80-30)56-38(93)43(24(10-90)117-56)123-129(104,105)113-14-28-46(41(96)59(121-28)88-20-77-35-49(68)71-17-74-52(35)88)127-132(110,111)116-15-29-47(42(97)60(122-29)89-21-78-36-50(69)72-18-75-53(36)89)126-131(108,109)115-13-27-45(40(95)58(120-27)86-8-5-32(66)82-63(86)101)125-130(106,107)114-12-26-44(39(94)57(119-26)85-7-4-31(65)81-62(85)100)124-128(102,103)112-11-25-33(83-54(98)23(79-22-91)2-1-9-133)37(92)55(118-25)87-19-76-34-48(67)70-16-73-51(34)87/h3-8,16-29,33,37-47,55-60,90,92-97,133H,1-2,9-15H2,(H,79,91)(H,83,98)(H,102,103)(H,104,105)(H,106,107)(H,108,109)(H,110,111)(H2,64,80,99)(H2,65,81,100)(H2,66,82,101)(H2,67,70,73)(H2,68,71,74)(H2,69,72,75)/t23?,24-,25-,26-,27-,28-,29-,33-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,55-,56-,57-,58-,59-,60-/m1/s1

• Std. InChIKey

  UTGGMUGWBYIUCC-QIXBJZLPSA-N

• Cite this record

  CSID:8527083, http://www.chemspider.com/Chemical-Structure.8527083.html (accessed 23:33, Apr 16, 2024)