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Cholesterol (D7)

CAT: 0926-IDA19947-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-IDA19947-01Size:25 mg
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CAS Number
83199-47-7
MDL Number
MFCD00209700
Smiles
[2H]C ([2H]) ([2H]) C ([2H]) (CCC[C@@H] (C) [C@H]1CC[C@@H]2[C@@]1 (CC[C@H]3[C@H]2CC=C4[C@@]3 (CC[C@@H] (C4) O) C) C) C ([2H]) ([2H]) [2H]
Molecular Formula
C27H39D7O
Molecular Weight
393.7 g/mol
Controlled
Yes

Chemical Information

Cholesterol-25,26,26,26,27,27,27-d7

Cholesterol_d7 is a cholestanoid.

CAS Number83199-47-7
PubChem CID5314029
IUPAC Name(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Molecular FormulaC27H46O
Molecular Weight393.7
XLogP8.7
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity591
SMILES
[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C([2H])([2H])[2H]
InChI
InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i1D3,2D3,18D
InChIKey
HVYWMOMLDIMFJA-IFAPJKRJSA-N
Chemical Structure
2D Structure
2D structure of Cholesterol-25,26,26,26,27,27,27-d7
CAS: 83199-47-7
CID: 5314029
Formula: C27H46O
MW: 393.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight393.7
XLogP38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass393.398803308
Monoisotopic Mass393.398803308
Topological Polar Surface Area20.2 Ų
Heavy Atom Count28
Formal Charge0
Complexity591
Isotope Atom Count7
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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Alternative Products

CatalogName
006797Cholesterol-d7
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HY-113342S7-Keto Cholesterol-d7
163090Cholesterol 3-Acetate-d7
01356720α-Hydroxy Cholesterol-d7
MBS6067112-014beta-Hydroxy Cholesterol-d7
HY-W740167-013-Keto Cholesterol-d7
0135614β-Hydroxy Cholesterol-d7
163091Cholesterol-d7 Tetrahydropyranyl Ether
TRC-H918002-1MG20Alpha-Hydroxy Cholesterol-d7

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