Chemical Compound

A10458

CAS Registry Number 13422-51-0
A10458 chemical structure
Primary Record

A10458

In stock
822 g
Purity
99.2 %
CAS
13422-51-0

Compound Identifiers & Properties

CAS
13422-51-0
PubChem CID
176519892
SMILES
CC[C@H]1[C@H]2[C@]3([C@@](C(/C(=C(\C4=N/C(=C\C5=NC(=C(C(=N2)[C]1CCC(=O)NC[C@@H](C)OP(=O)([O-])O[C@H]6[CH][C@H](O[C@@H]6CO)N7C=NC8=C7C=C(C(=C8)C)C)C)[C@H](C5(C)C)CCC(=O)N)/[C@H]([C@]4(C)CC(=O)N)CCC(=O)N)/C)/[N-]3)CCC(=O)N)(C)CC(=O)N)C
Canonical SMILES
CC[C@@H]1[C](CCC(=O)NC[C@@H](C)OP(=O)([O-])O[C@H]2[CH][C@@H](n3cnc4cc(C)c(C)cc43)O[C@@H]2CO)C2=N[C@@H]1[C@]1(C)[N-]/C(=C(\C)C3=N/C(=C\C4=NC(=C2C)[C@@H](CCC(N)=O)C4(C)C)[C@@H](CCC(N)=O)[C@]3(C)CC(N)=O)C(CCC(N)=O)[C@]1(C)CC(N)=O

Names & Synonyms

  • A10458
  • 13422-51-0