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Structure

Pregnenolone-17alpha,21,21,21-d4

CAS
61574-54-7
Catalog Number
ACM61574547
Category
Other Products
Molecular Weight
320.5
Molecular Formula
C21H28D4O2

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Specification

Synonyms
PREGNENOLONE-17ALPHA,21,21,21-D4;Pregnenolone-17α,21,21,21-D4
IUPAC Name
2,2,2-trideuterio-1-[(3S,8S,9S,10R,13S,14S,17S)-17-deuterio-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone
Canonical SMILES
CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
InChI Key
ORNBQBCIOKFOEO-QVFJSNPXSA-N
Exact Mass
320.26500
H-Bond Acceptor
2
H-Bond Donor
1
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