Products for Research Use Only
RegisterLogin

Cholesteryl-N, N-dimethylethanolamine

CAT: 0926-FC172053-01Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-FC172053-01Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
7694-43-1
Smiles
C[C@@]1 ([C@@H] ([C@H] (C) CCCC (C) C) CC2) [C@]2 ([H]) [C@]3 ([H]) CC=C4C[C@@H] (OCCN (C) C) CC[C@]4 (C) [C@@]3 ([H]) CC1
Molecular Formula
C31H55NO
Molecular Weight
457.8 g/mol
Controlled
No

Chemical Information

Cholesteryl-N,N-Dimethylethanolamine
CAS Number7694-43-1
PubChem CID16659503
IUPAC Name2-[[(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]oxy]-N,N-dimethylethanamine
Molecular FormulaC31H55NO
Molecular Weight457.8
XLogP9.1
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Heavy Atom Count33
Formal Charge0
Complexity682
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)OCCN(C)C)C)C
InChI
InChI=1S/C31H55NO/c1-22(2)9-8-10-23(3)27-13-14-28-26-12-11-24-21-25(33-20-19-32(6)7)15-17-30(24,4)29(26)16-18-31(27,28)5/h11,22-23,25-29H,8-10,12-21H2,1-7H3/t23-,25+,26+,27-,28+,29+,30+,31-/m1/s1
InChIKey
UHNXOFNYRNSBID-BWVDWJPHSA-N
Chemical Structure
2D Structure
2D structure of Cholesteryl-N,N-Dimethylethanolamine
CAS: 7694-43-1
CID: 16659503
Formula: C31H55NO
MW: 457.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight457.8
XLogP39.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass457.428365378
Monoisotopic Mass457.428365378
Topological Polar Surface Area12.5 Ų
Heavy Atom Count33
Formal Charge0
Complexity682
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

Related Products

CatalogName
FD172101-011,3-Dipalmitoylglycero-2-phospho-N, N-dimethylethanolamine
FD172108-011,2-Distearoyl-sn-glycero-3-phospho-N, N-dimethylethanolamine
FD172091-011,2-Dimyristoyl-rac-glycero-3-phospho-N, N-dimethylethanolamine
FD172100-011,2-Dipalmitoyl-sn-glycero-3-phospho-N, N-dimethylethanolamine
FD172099-011,2-Dipalmitoyl-rac-glycero-3-phospho-N, N-dimethylethanolamine
FD172072-011,2-Di-O-hexadecyl-sn-glycero-3-phospho-N, N-dimethylethanolamine
FO172262-011-O-Octadecyl-2-O-methyl-rac-glycero-3-phospho-N, N-dimethylethanolamine
ZCA89297-01Cholesteryl eicosapentaenoate
YCA02496-01Cholesteryl lignocerate
CAA93080Cholesteryl iodide

Alternative Products

CatalogName
108-01-1N, N-Dimethylethanolamine
D40040-01N, N-Dimethylethanolamine 99%
D471171N,N-Dimethylethanolamine-d10 (OH)
84275711N, N-Dimethylethanolamine (2-Dimethylaminoethanol)
TYD-00763-01Cholesteryl n-butyrate
sc-211086Cholesteryl n-valerate
sc-214702Cholesteryl n-decanoate
HY-141615-011,2-Dipalmitoyl-sn-glycero-3-phospho-N, N-dimethylethanolamine
C21210Cholesteryl n-valerate 95%
BIB60441,2-Dipalmitoyl-rac-glycero-3-phospho-N, N-dimethylethanolamine

Popular Products