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MOCHOL

CAT: 0013-GTR19260312-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19260312-01Size:100 mg
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Description
Mochol is a derivative of cholesterol. Mochol is a useful lipid for nanoliposome formulation of DNA, RNA, and vaccines.
CAS Number
452323-21-6
Purity
>98%
Molecular Formula
C37H62N2O4
Molecular Weight
598.47
Notes
For research use only.

Chemical Information

Mochol
CAS Number452323-21-6
PubChem CID25065406
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] 4-(2-morpholin-4-ylethylamino)-4-oxobutanoate
Molecular FormulaC37H62N2O4
Molecular Weight598.9
XLogP8
Topological Polar Surface Area67.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count43
Formal Charge0
Complexity989
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)CCC(=O)NCCN5CCOCC5)C)C
InChI
InChI=1S/C37H62N2O4/c1-26(2)7-6-8-27(3)31-11-12-32-30-10-9-28-25-29(15-17-36(28,4)33(30)16-18-37(31,32)5)43-35(41)14-13-34(40)38-19-20-39-21-23-42-24-22-39/h9,26-27,29-33H,6-8,10-25H2,1-5H3,(H,38,40)/t27-,29+,30+,31-,32+,33+,36+,37-/m1/s1
InChIKey
HEZIVRACDFRXBU-PKHDATKRSA-N
Chemical Structure
2D Structure
2D structure of Mochol
CAS: 452323-21-6
CID: 25065406
Formula: C37H62N2O4
MW: 598.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight598.9
XLogP38
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass598.47095846
Monoisotopic Mass598.47095846
Topological Polar Surface Area67.9 Ų
Heavy Atom Count43
Formal Charge0
Complexity989
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

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