Neopterin

CAS Registry Number®

2009-64-5
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CAS Name

Neopterin

Molecular Formula

C9H11N5O4

Molecular Mass

253.21

Cite this Page

Neopterin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=2009-64-5 (retrieved 2024-04-19) (CAS RN: 2009-64-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m1/s1

InChIKey

InChIKey=BMQYVXCPAOLZOK-XINAWCOVSA-N

SMILES

O=C1C=2C(NC=C([C@@H]([C@@H](CO)O)O)N2)=NC(N)=N1

Canonical SMILES

O=C1N=C(N=C2NC=C(N=C12)C(O)C(O)CO)N

Other Names for this Substance

  • 4(3H)-Pteridinone, 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-
  • 1,2,3-Propanetriol, 1-(2-amino-4-hydroxy-6-pteridinyl)-, D-erythro-
  • Neopterin
  • 4(1H)-Pteridinone, 2-amino-6-(1,2,3-trihydroxypropyl)-, [S-(R*,S*)]-
  • 4(1H)-Pteridinone, 2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-

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Deleted or Replaced CAS Registry Numbers

670-65-5, 2236-62-6, 6386-32-9

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