7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with [R-(R*,S*)]-α-[1-(methylamino)ethyl]benzenemethanol (1:1)

CAS Registry Number®

29701-08-4
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CAS Name

7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with [R-(R*,S*)]-α-[1-(methylamino)ethyl]benzenemethanol (1:1)

Molecular Formula

C10H15NO.C9H10N4O4

Cite this Page

7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with [R-(R*,S*)]-α-[1-(methylamino)ethyl]benzenemethanol (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29701-08-4 (retrieved 2024-04-24) (CAS RN: 29701-08-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H15NO.C9H10N4O4/c1-8(11-2)10(12)9-6-4-3-5-7-9;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-8,10-12H,1-2H3;4H,3H2,1-2H3,(H,14,15)/t8-,10-;/m0./s1

InChIKey

InChIKey=YSIIKGUQUONBTG-GNAZCLTHSA-N

SMILES

C(C(O)=O)N1C2=C(N(C)C(=O)N(C)C2=O)N=C1.[C@@H]([C@@H](NC)C)(O)C1=CC=CC=C1

Canonical SMILES

O=C(O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C.OC(C=1C=CC=CC1)C(NC)C

Other Names for this Substance

  • 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with [R-(R*,S*)]-α-[1-(methylamino)ethyl]benzenemethanol (1:1)
  • Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with (-)-ephedrine (1:1)
  • Ephedrine, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-acetate (salt), (-)-
  • Benzenemethanol, α-[1-(methylamino)ethyl]-, [R-(R*,S*)]-, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate (salt)
  • Ephedrine theophylline-7-acetate

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