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Structure

3-O-Benzyl estradiol

CAS
14982-15-1
Catalog Number
ACM14982151
Category
Other Products
Molecular Weight
362.50
Molecular Formula
C25H30O2

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Specification

Synonyms
(17β)-3-(Phenylmethoxy)-estra-1,3,5(10)-trien-17-ol; 3-(Benzyloxy)-estra-1,3,5(10)-trien-17β-ol; BLE 99051; Estradiol 3-Benzyl Ether;
IUPAC Name
(8R,9S,13S,14S,17S)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
Canonical SMILES
CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OCC5=CC=CC=C5
InChI Key
KTONJCQNAMVMHS-VAFBSOEGSA-N
Exact Mass
362.22500
H-Bond Acceptor
2
H-Bond Donor
1
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