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Structure

4-Methoxy-13c,d3-estrone

CAS
1217437-34-7
Catalog Number
ACM1217437347
Category
Other Products
Molecular Weight
304.40
Molecular Formula
(13C)C18D3H21O3

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Specification

Synonyms
3-Hydroxy-4-methoxyestra-1,3,5(10)-trien-17-one-13C,d3;
IUPAC Name
(8R,9S,13S,14S)-3-hydroxy-13-methyl-4-(trideuteriomethoxy)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Canonical SMILES
CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4OC)O
InChI Key
PUEXVLNGOBYUEW-VWXYHFCISA-N
Exact Mass
304.19500
H-Bond Acceptor
3
H-Bond Donor
1
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