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DC-cholesterol

CAT: 1118-LP-R4-491-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1118-LP-R4-491-02Size:100 mg
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CAS Number
137056-72-5
Purity
≥95% (HPLC)
Molecular Weight
500.8
Related Products
SCS (High Purity >98%), BHE-Cholesterol, BHEM-Cholesterol, bromide, BHEM-Cholesterol, Iodide, BotaniChol® (Cholesterol from plant origin), CHEMS, CHEMS-PEG-2000, CHEMS-PEG-5000, MOCHOL, NMDC-Cholesterol, Sitostanol, Stigmasterol
Grade
R&D

Chemical Information

3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol

used to prepare sonicated liposomes

CAS Number137056-72-5
PubChem CID115234
IUPAC Name[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[2-(dimethylamino)ethyl]carbamate
Molecular FormulaC32H56N2O2
Molecular Weight500.8
XLogP9
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count36
Formal Charge0
Complexity791
SMILES
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)NCCN(C)C)C)C
InChI
InChI=1S/C32H56N2O2/c1-22(2)9-8-10-23(3)27-13-14-28-26-12-11-24-21-25(36-30(35)33-19-20-34(6)7)15-17-31(24,4)29(26)16-18-32(27,28)5/h11,22-23,25-29H,8-10,12-21H2,1-7H3,(H,33,35)/t23-,25+,26+,27-,28+,29+,31+,32-/m1/s1
InChIKey
HIHOWBSBBDRPDW-PTHRTHQKSA-N
Chemical Structure
2D Structure
2D structure of 3-(N-(N',N'-dimethylaminoethane)carbamoyl)cholesterol
CAS: 137056-72-5
CID: 115234
Formula: C32H56N2O2
MW: 500.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight500.8
XLogP39
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass500.43417903
Monoisotopic Mass500.43417903
Topological Polar Surface Area41.6 Ų
Heavy Atom Count36
Formal Charge0
Complexity791
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes