Chemical Compound

3D-Phad

CAS Registry Number 1699735-79-9
3D-Phad chemical structure
Primary Record

3D-Phad

In stock
7,579 g
Purity
98.1 %
CAS
1699735-79-9

Compound Identifiers & Properties

CAS
1699735-79-9
PubChem CID
145721981
SMILES
CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OP(=O)(O)[O-])CO)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O)NC(=O)C[C@@H](CCCCCCCCCCC)O)O)O)NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCC.[NH4+]
Canonical SMILES
CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)O[C@@H]1[C@@H](NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)[C@H](OC[C@H]2O[C@H](O)[C@H](NC(=O)C[C@H](O)CCCCCCCCCCC)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@H]1OP(=O)([O-])O.[NH4+]

Names & Synonyms

  • 3D-Phad
  • UNII-Q4VSD9WE5I
  • Q4VSD9WE5I
  • Monophosphoryl 3-deacyl lipid A (synthetic)
  • Monophosphoryl 3-deacyl lipid A ammonium salt
  • 1699735-79-9
  • azanium;[(2R,3S,4R,5R,6R)-5-[[(3R)-3-dodecanoyloxytetradecanoyl]amino]-2-(hydroxymethyl)-4-[(3R)-3-tetradecanoyloxytetradecanoyl]oxy-6-[[(2R,3S,4R,5R,6S)-3,4,6-trihydroxy-5-[[(3R)-3-hydroxytetradecanoyl]amino]oxan-2-yl]methoxy]oxan-3-yl] hydrogen phosphate