Chemical Compound

DTXSID401362522

CAS Registry Number 120334-36-3
DTXSID401362522 chemical structure
Primary Record

DTXSID401362522

In stock
9,963 g
Purity
98.9 %
CAS
120334-36-3

Compound Identifiers & Properties

CAS
120334-36-3
PubChem CID
177842418
SMILES
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)[N+](=O)[O-])CC(=O)[O-].CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)[N+](=O)[O-])CC(=O)[O-].COC1=CC2=C(C=C[NH+]=C2C=C1)[C@H]([C@@H]3C[C@@H]4CC[NH+]3C[C@@H]4C=C)O
Canonical SMILES
C=C[C@H]1C[NH+]2CC[C@H]1C[C@H]2[C@H](O)c1cc[nH+]c2ccc(OC)cc12.Cn1c(=O)c2c(nc([N+](=O)[O-])n2CC(=O)[O-])n(C)c1=O.Cn1c(=O)c2c(nc([N+](=O)[O-])n2CC(=O)[O-])n(C)c1=O

Names & Synonyms

  • DTXSID401362522
  • 120334-36-3
  • Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-8-nitro-2,6-dioxo-, quinine salt (2:1)