N-[4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-glutamic Acid 1,

For research use only. Not for therapeutic Use.

  • CAT Number: R015475
  • CAS Number: 165049-28-5
  • Molecular Formula: C31H37N5O9S
  • Molecular Weight: 655.723
  • Purity: ≥95%
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Catalog Number R015475
CAS Number 165049-28-5
Molecular Formula C31H37N5O9S
Purity ≥95%
Storage -20°C
IUPAC Name diethyl (2S)-2-[[4-[2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioate;4-methylbenzenesulfonic acid
InChI InChI=1S/C24H29N5O6.C7H8O3S/c1-3-34-18(30)12-11-17(23(33)35-4-2)27-21(31)15-8-5-14(6-9-15)7-10-16-13-26-20-19(16)22(32)29-24(25)28-20;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,8-9,13,17H,3-4,7,10-12H2,1-2H3,(H,27,31)(H4,25,26,28,29,32);2-5H,1H3,(H,8,9,10)/t17-;/m0./s1
InChIKey UANBXQTVHOIGGQ-LMOVPXPDSA-N
SMILES CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCC2=CNC3=C2C(=O)N=C(N3)N.CC1=CC=C(C=C1)S(=O)(=O)O

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