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Chemical structure of 2-Hydroxyestradiol-d5

GC70560

2-Hydroxyestradiol-d5

Also known as (8R,9S,13S,14S,17S)-1,4,16,16,17-pentadeuterio-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-2,3,17-triol

2-Hydroxyestradiol-d5 is the deuterium labeled 2-Hydroxyestradiol

ChemicalCAS221093-33-0MW293.41FormulaC18H19D5O3
CAS number
221093-33-0
Molecular weight
293.41
Formula
C18H19D5O3
InChIKey
DILDHNKDVHLEQB-MLEVBVPTSA-N
Catalogue number
GC70560
Brand
GLPBIO
Computed properties PubChem CID 76973771 · XLogP 3.7 · TPSA 60.7 Ų · H-bond donors 3
XLogP
3.7
TPSA
60.7 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
21

SMILES [2H]C1=C2CC[C@@H]3[C@@H](C2=C(C(=C1O)O)[2H])CC[C@]4([C@H]3CC([C@]4([2H])O)([2H])[2H])C

Computed descriptors from PubChem (CID 76973771), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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