2,5-Diamino-6-[(5-O-phosphono-β-D-ribofuranosyl)amino]-4(1H)-pyrimidinone

CAS Registry Number®

73477-63-1
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CAS Name

2,5-Diamino-6-[(5-O-phosphono-β-D-ribofuranosyl)amino]-4(1H)-pyrimidinone

Molecular Formula

C9H16N5O8P

Molecular Mass

353.23

Cite this Page

2,5-Diamino-6-[(5-O-phosphono-β-D-ribofuranosyl)amino]-4(1H)-pyrimidinone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=73477-63-1 (retrieved 2024-05-05) (CAS RN: 73477-63-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H16N5O8P/c10-3-6(13-9(11)14-7(3)17)12-8-5(16)4(15)2(22-8)1-21-23(18,19)20/h2,4-5,8,15-16H,1,10H2,(H2,18,19,20)(H4,11,12,13,14,17)/t2-,4-,5-,8-/m1/s1

InChIKey

InChIKey=OCLCLRXKNJCOJD-UMMCILCDSA-N

SMILES

N([C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)C2=C(N)C(=O)N=C(N)N2

Canonical SMILES

O=C1N=C(N)NC(NC2OC(COP(=O)(O)O)C(O)C2O)=C1N

Other Names for this Substance

  • 4(1H)-Pyrimidinone, 2,5-diamino-6-[(5-O-phosphono-β-D-ribofuranosyl)amino]-
  • 2,5-Diamino-6-[(5-O-phosphono-β-D-ribofuranosyl)amino]-4(1H)-pyrimidinone

Deleted or Replaced CAS Registry Numbers

392662-80-5

CAS INSIGHTSTM
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