3,7-Dihydro-7-[2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione

CAS Registry Number®

58166-83-9

CAS Name

3,7-Dihydro-7-[2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione

Molecular Formula

C18H23N5O3

Molecular Mass

357.41

Cite this Page

3,7-Dihydro-7-[2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58166-83-9 (retrieved 2024-11-22) (CAS RN: 58166-83-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H23N5O3/c1-12(15(24)13-7-5-4-6-8-13)19-9-10-23-11-20-16-14(23)17(25)22(3)18(26)21(16)2/h4-8,11-12,15,19,24H,9-10H2,1-3H3/t12-,15-/m0/s1

InChIKey

InChIKey=UJSKUDDDPKGBJY-WFASDCNBSA-N

SMILES

C(CN[C@H]([C@H](O)C1=CC=CC=C1)C)N2C3=C(N(C)C(=O)N(C)C3=O)N=C2

Canonical SMILES

O=C1C2=C(N=CN2CCNC(C)C(O)C=3C=CC=CC3)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-[2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]amino]ethyl]-1,3-dimethyl-
  • 3,7-Dihydro-7-[2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenylethyl]amino]ethyl]-1,3-dimethyl-1H-purine-2,6-dione
  • Cafedrine
  • (-)-Cafedrine
  • l-Cafedrine

Deleted or Replaced CAS Registry Numbers

78396-34-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration