Chemical Compound

18:1-12:0 Biotin CA

CAS Registry Number 799812-68-3
18:1-12:0 Biotin CA chemical structure
Primary Record

18:1-12:0 Biotin CA

In stock
9,412 g
Purity
99.6 %
CAS
799812-68-3

Compound Identifiers & Properties

CAS
799812-68-3
PubChem CID
46891748
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2)COP(=O)(OCC(O)COP(=O)(OC[C@H](OC(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]3SC[C@H]4[C@@H]3NC(=O)N4)COC(=O)CCCCCCC/C=C\CCCCCCCC)[O-])[O-].[NH4+].[NH4+]
Canonical SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC(O)COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)OC(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21.[NH4+].[NH4+]

Names & Synonyms

  • 18:1-12:0 Biotin CA
  • DTXSID80677057
  • 799812-68-3
  • 1,1'oleoyl-2,2'-[12-biotinyl(aminolauroyl)] cardiolipin (ammonium salt)
  • Bisammonium 2-hydroxypropane-1,3-diyl bis[(2R)-3-{[(9Z)-octadec-9-enoyl]oxy}-2-{[12-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)dodecanoyl]oxy}propyl] bis(phosphate)
  • Diammonium 2-hydroxypropane-1,3-diyl bis{(2R)-3-{[(9Z)-octadec-9-enoyl]oxy}-2-[(12-{5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}dodecanoyl)oxy]propyl} bis(phosphate)