3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate
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- structure.search.product.name 3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate
- Product Code: TRC-C292500
- CAS Number: 75621-03-3
- Brand: TRC
Product Overview
Product Code
TRC-C292500
CAS Number
Product Format
Neat
Molecular Formula
C32 H58 N2 O7 S
Molecular Weight
614.88
Product Categories
Product Type
Bioactive Small MoleculeDocumentation
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Product Information
Chemical Data
Analyte Name
3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate
CAS Number
75621-03-3
Molecular Formula
C32 H58 N2 O7 S
Molecular Weight
614.88
Accurate Mass
614.3965
SMILES
C[C@H](CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
InChI
InChI=1S/C32H58N2O7S/c1-21(8-11-29(38)33-14-6-15-34(4,5)16-7-17-42(39,40)41)24-9-10-25-30-26(20-28(37)32(24,25)3)31(2)13-12-23(35)18-22(31)19-27(30)36/h21-28,30,35-37H,6-20H2,1-5H3,(H-,33,38,39,40,41)/t21-,22+,23-,24-,25+,26+,27-,28+,30+,31+,32-/m1/s1
IUPAC
3-[dimethyl-[3-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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]azaniumyl]propane-1-sulfonate
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat