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Chemical structure of Deoxycorticosterone-d8

GC70374

Deoxycorticosterone-d8

Also known as (8S,9S,10R,13S,14S,17S)-2,2,4,6,6,17-hexadeuterio-17-(2,2-dideuterio-2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one

Deoxycorticosterone-d8 is the deuterium labeled Deoxycorticosterone

ChemicalCAS55487-63-3MW338.51FormulaC21H22D8O3
CAS number
55487-63-3
Molecular weight
338.51
Formula
C21H22D8O3
Solubility
DMSO ： 250 mg/mL (738·53 mM; Need ultrasonic and warming); DMSO ： ≥ 250 mg/mL (738·53 mM)
InChIKey
ZESRJSPZRDMNHY-JRMIWGODSA-N
Catalogue number
GC70374
Brand
GLPBIO
Computed properties PubChem CID 90473442 · XLogP 2.9 · TPSA 54.4 Ų · H-bond donors 1
XLogP
2.9
TPSA
54.4 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24

SMILES [2H]C1=C2[C@](CC(C1=O)([2H])[2H])([C@H]3CC[C@]4([C@H]([C@@H]3CC2([2H])[2H])CC[C@]4([2H])C(=O)C([2H])([2H])O)C)C

Computed descriptors from PubChem (CID 90473442), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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