Chemical Compound

DTXSID40930493

CAS Registry Number 139501-89-6
DTXSID40930493 chemical structure
Primary Record

DTXSID40930493

In stock
1,856 g
Purity
98.2 %
CAS
139501-89-6

Compound Identifiers & Properties

CAS
139501-89-6
PubChem CID
138397902
SMILES
CC1C(C(C(C(O1)OC2C(C3=CC4=C(C(=C3C5=C2C=C(C(=C5[O-])C(=O)NC(C)C(=O)O)C)[O-])C(=O)C6=C(C4=O)C(=CC(=C6)OC)O)O)O)OC7C(C(C(CO7)OS(=O)(=O)O)O)O)O.[Na+].[Na+]
Canonical SMILES
COc1cc(O)c2c(c1)C(=O)c1c(cc3c(c1[O-])-c1c(cc(C)c(C(=O)NC(C)C(=O)O)c1[O-])C(OC1OC(C)C(O)C(OC4OCC(OS(=O)(=O)O)C(O)C4O)C1O)C3O)C2=O.[Na+].[Na+]

Names & Synonyms

  • DTXSID40930493
  • 139501-89-6
  • Disodium 2-{[(1-carboxyethyl)imino](hydroxy)methyl}-5-{[6-deoxy-3-O-(4-O-sulfopentopyranosyl)hexopyranosyl]oxy}-6,14-dihydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-1,9-bis(olate)