Chemical Compound

E-5531 tetrasodium

CAS Registry Number 151663-12-6
E-5531 tetrasodium chemical structure
Primary Record

E-5531 tetrasodium

In stock
3,948 g
Purity
99.5 %
CAS
151663-12-6

Compound Identifiers & Properties

CAS
151663-12-6
PubChem CID
9812656
SMILES
CCCCCCCCCCCC(=O)CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OP(=O)([O-])[O-])CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC)OP(=O)([O-])[O-])OCC[C@@H](CCCCCCC)OC(=O)CCC/C=C\CCCCCC)NC(=O)CC(=O)CCCCCCCCCCC)O)OCC[C@@H](CCCCCCC)O.[Na+].[Na+].[Na+].[Na+]
Canonical SMILES
CCCCCC/C=C\CCCC(=O)O[C@H](CCCCCCC)CCO[C@@H]1[C@@H](NC(=O)CC(=O)CCCCCCCCCCC)[C@H](OC[C@H]2O[C@H](OP(=O)([O-])[O-])[C@H](NC(=O)CC(=O)CCCCCCCCCCC)[C@@H](OCC[C@H](O)CCCCCCC)[C@@H]2O)O[C@H](COC)[C@H]1OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

Names & Synonyms

  • E-5531 tetrasodium
  • HX9L0AHW4Z
  • UNII-HX9L0AHW4Z
  • CID9812656
  • CID 9812656
  • 151663-12-6
  • 2-Deoxy-6-O-(2-deoxy-3-O-((R)-3-(Z)-dodec-5-enoyloxydecyl)-6-O-methyl-2-(3-oxotetradecanoylamino)-4-o-phosphonato-b-D-glucopyrnosyl)-3-O-((R)-3-hydroxydecyl)-2-(3-oxotetradecanoylamino)-a-D-glucopyranosylphosphate tetrasodium
  • .ALPHA.-D-GLUCOPYRANOSE, 2-DEOXY-6-O-(2-DEOXY-2-((1,3-DIOXOTETRADECYL)AMINO)-6-O-METHYL-3-O-((3R)-3-(((5Z)-1-OXO-5-DODECENYL)OXY)DECYL)-4-O-PHOSPHONO-.BETA.-D-GLUCOPYRANOSYL)-2-((1,3-DIOXOTETRADECYL)AMINO)-3-O-((3R)-3-HYDROXYDECYL)-, 1-(DIHYDROGEN PHOSPHATE), TETRASODIUM SALT
  • .ALPHA.-D-GLUCOPYRANOSE, 2-DEOXY-6-O-(2-DEOXY-2-((1,3-DIOXOTETRADECYL)AMINO)-6-O-METHYL-3-O-(3-((1-OXO-5-DODECENYL)OXY)DECYL)-4-O-PHOSPHONO-.BETA.-D-GLUCOPYRANOSYL)-2-((1,3-DIOXOTETRADECYL)AMINO)-3-O-(3-HYDROXYDECYL)-, 1-(DIHYDROGEN PHOSPHATE), TETRASODIUM SALT, (3(R),6(R(Z)))-