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Chemical structure of 4β-Hydroxycholesterol-d4

GC70557

4β-Hydroxycholesterol-d4

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

4β-Hydroxycholesterol-d4 is the deuterium labeled 4β-Hydroxycholesterol

ChemicalCAS1363529-44-5MW406.68FormulaC27H42D4O2
CAS number
1363529-44-5
Molecular weight
406.68
Formula
C27H42D4O2
Solubility
DMSO ： 5 mg/mL (12·29 mM; ultrasonic and warming and heat to 60°C; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
CZDKQKOAHAICSF-LIDHSRKFSA-N
Catalogue number
GC70557
Brand
GLPBIO
Computed properties PubChem CID 57332228 · XLogP 7.4 · TPSA 40.5 Ų · H-bond donors 2
XLogP
7.4
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
29

SMILES [2H]C([2H])([2H])C([2H])(C)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]([C@@H]4O)O)C)C

Computed descriptors from PubChem (CID 57332228), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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