| CAS Number | 166023-21-8 |
| Catalog Number | AG00APEG |
| Chemical Name | DC-Chol HCl |
| IUPAC Name | [10,13-dimethyl-17-(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;hydrochloride |
| InChI | InChI=1S/C32H56N2O2.ClH/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);1H |
| InChI Key | ISXSJGHXHUZXNF-UHFFFAOYSA-N |
| MDL Number | MFCD27980212 |
| Molecular Formula | C32H57ClN2O2 |
| Molecular Weight | 537.2602 |
| SMILES | O=C(O[C@H]1CC[C@]2(C)C3CC[C@]4(C)[C@@H]([C@H](C)CCCC(C)C)CCC4C3CC=C2C1)NCCN(C)C.[H]Cl |
| Synonyms | DC-Cholesterol,
166023-21-8,
DC Cholesterol,
CTK8E7234,
ISXSJGHXHUZXNF-UHFFFAOYSA-N,
AKOS025294674,
RT-012231,
KS-00001819,
|
| Complexity | 791 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 536.411g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 37 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 537.27g/mol |
| Monoisotopic Mass | 536.411g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 8 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number