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Chemical structure of 5α-Cholestane-d6

GC68567

5α-Cholestane-d6

Also known as (8R,9S,10S,13R,14S,17R)-2,2,3,3,4,4-hexadeuterio-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene

5α-Cholestane-d6 is the deuterated form of 5α-Cholestane

ChemicalCAS358731-18-7MW378.71FormulaC27H42D6
CAS number
358731-18-7
Molecular weight
378.71
Formula
C27H42D6
Solubility
Ethanol ： ≥ 20 mg/mL (52·81 mM); DMF ： ≥ 1 mg/mL (2·64 mM); Ethanol：PBS (pH 7·2)(1：2) ： ≥ 0·3 mg/mL (0·79 mM); DMSO ： ≥ 0·1 mg/mL (0·26 mM)
InChIKey
XIIAYQZJNBULGD-PTHKICKKSA-N
Catalogue number
GC68567
Brand
GLPBIO
Computed properties PubChem CID 90472220 · XLogP 11.1 · TPSA 0 Ų · H-bond donors 0
XLogP
11.1
TPSA
0 Ų
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
5
Heavy atoms
27

SMILES [2H]C1(C[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CCC2C(C1([2H])[2H])([2H])[2H])CC[C@@H]4[C@H](C)CCCC(C)C)C)C)[2H]

Computed descriptors from PubChem (CID 90472220), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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