3-((3-deoxycholamidopropyl)dimethylammonio)-1-propane

For research use only. Not for therapeutic Use.

  • CAT Number: M003190
  • CAS Number: 106679-03-2
  • Molecular Formula: C32H58N2O6S
  • Molecular Weight: 598.884
  • Purity: ≥95%
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Catalog Number M003190
CAS Number 106679-03-2
Synonyms

3-((3-deoxycholamidopropyl)dimethylammonio)-1-propane

Molecular Formula C32H58N2O6S
Purity ≥95%
Storage -20°C
IUPAC Name 3-[3-[[(4R)-4-[(5S,7R,10S,12S,13R,17S)-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]propyl-dimethylazaniumyl]propane-1-sulfonate
InChI InChI=1S/C32H58N2O6S/c1-22(11-14-29(37)33-16-8-17-34(4,5)18-9-19-41(38,39)40)24-12-13-25-30-26(21-28(36)32(24,25)3)31(2)15-7-6-10-23(31)20-27(30)35/h22-28,30,35-36H,6-21H2,1-5H3,(H-,33,37,38,39,40)/t22-,23+,24+,25?,26?,27-,28+,30?,31+,32-/m1/s1
InChIKey ZQDSFVARABYERY-HJSAWXBPSA-N
SMILES CC(CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCCC4)C)O)O)C

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