Queuine

CAS Registry Number®

72496-59-4
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CAS Name

Queuine

Molecular Formula

C12H15N5O3

Molecular Mass

277.28

Cite this Page

Queuine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=72496-59-4 (retrieved 2024-04-24) (CAS RN: 72496-59-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15N5O3/c13-12-16-10-8(11(20)17-12)5(4-15-10)3-14-6-1-2-7(18)9(6)19/h1-2,4,6-7,9,14,18-19H,3H2,(H4,13,15,16,17,20)/t6-,7-,9+/m0/s1

InChIKey

InChIKey=WYROLENTHWJFLR-ACLDMZEESA-N

SMILES

C(N[C@@H]1[C@@H](O)[C@@H](O)C=C1)C=2C3=C(NC2)NC(N)=NC3=O

Canonical SMILES

O=C1N=C(N)NC=2NC=C(C12)CNC3C=CC(O)C3O

Other Names for this Substance

  • 4H-Pyrrolo[2,3-d]pyrimidin-4-one, 2-amino-5-[[[(1S,4S,5R)-4,5-dihydroxy-2-cyclopenten-1-yl]amino]methyl]-1,7-dihydro-
  • 4H-Pyrrolo[2,3-d]pyrimidin-4-one, 2-amino-5-[[(4,5-dihydroxy-2-cyclopenten-1-yl)amino]methyl]-1,7-dihydro-, [1S-(1α,4β,5β)]-
  • 2-Amino-5-[[[(1S,4S,5R)-4,5-dihydroxy-2-cyclopenten-1-yl]amino]methyl]-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
  • Queuine

CAS INSIGHTSTM
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