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Structure

17-Hydroxy-3-methoxyestra-2,5(10)-diene-17-carbonitrile

CAS
17006-17-6
Catalog Number
ACM17006176
Category
Other Products
Molecular Weight
313.434 g/mol
Molecular Formula
C20H27NO2

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Specification

Synonyms
EINECS 241-083-5, CID86496, 17-Hydroxy-3-methoxyestra-2,5(10)-diene-17-carbonitrile, 17006-17-6
IUPAC Name
17-hydroxy-3-methoxy-13-methyl-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile
Canonical SMILES
CC12CCC3C(C1CCC2(C#N)O)CCC4=C3CC=C(C4)OC
InChI Key
MEEGGHJZTZFSBQ-UHFFFAOYSA-N
EC Number
241-083-5
H-Bond Acceptor
3
H-Bond Donor
1
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