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Structure

18-Demethyl etonogestrel

CAS
54024-10-1
Catalog Number
ACM54024101
Category
Other Products
Molecular Weight
310.43
Molecular Formula
C21H26O2

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Specification

Synonyms
(17α)-17-Hydroxy-11-methylene-19-norpregn-4-en-20-yn-3-one;
IUPAC Name
(8S,10R,13S,17R)-17-ethynyl-17-hydroxy-13-methyl-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Canonical SMILES
CC12CC(=C)C3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
InChI Key
VBLPWTJRPURMLR-SXWQGVRPSA-N
Exact Mass
310.19300
H-Bond Acceptor
2
H-Bond Donor
1
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