Chemical Compound

J2.848.474G

J2.848.474G chemical structure
Primary Record

J2.848.474G

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
45258167
SMILES
C[C@H](CCC(=O)NCC#CC1=CN(C2=NC=NC(=C12)N)[C@H]3C[C@@H]([C@H](O3)CO)O)[C@H]4CC[C@@H]5[C@@]4([C@H](C[C@H]6[C@H]5CC[C@H]7[C@@]6(CC[C@H](C7)O)C)O)C
Canonical SMILES
C[C@H](CCC(=O)NCC#Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

Names & Synonyms

  • J2.848.474G
  • (4R)-4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11S,11aR)-7,11-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-N-(3-{4-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}prop-2-yn-1-yl)pentanamide
  • N-[3-[7-(2-Deoxy-beta-D-ribofuranosyl)-4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-yl]-2-propynyl]-3alpha,12alpha-dihydroxy-5beta-cholane-24-oic amide