4,6-Pteridinedione, 2-amino-3,5-dihydro-, hydrate (1:1)

CAS Registry Number®

5979-01-1

CAS Name

4,6-Pteridinedione, 2-amino-3,5-dihydro-, hydrate (1:1)

Molecular Formula

C6H5N5O2.H2O

Cite this Page

4,6-Pteridinedione, 2-amino-3,5-dihydro-, hydrate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5979-01-1 (retrieved 2024-10-06) (CAS RN: 5979-01-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H5N5O2.H2O/c7-6-10-4-3(5(13)11-6)9-2(12)1-8-4;/h1H,(H,9,12)(H3,7,8,10,11,13);1H2

InChIKey

InChIKey=GXYCFNCAIXIUMR-UHFFFAOYSA-N

SMILES

O=C1C2=C(NC(N)=N1)N=CC(=O)N2.O

Canonical SMILES

O=C1N=C(N)NC=2N=CC(=O)NC12.O

Other Names for this Substance

  • 4,6-Pteridinedione, 2-amino-3,5-dihydro-, hydrate (1:1)
  • 4,6-Pteridinediol, 2-amino-, hydrate
  • 4,6-Pteridinedione, 2-amino-1,5-dihydro-, monohydrate
  • Xanthopterin monohydrate

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox