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Structure

18-Methylethynyl estradiol

CAS
14012-72-7
Catalog Number
ACM14012727
Category
Other Products
Molecular Weight
310.43
Molecular Formula
C21H26O2

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Specification

Synonyms
(17α)-13-Ethyl-18,19-dinorpregna-1,3,5(10)-trien-20-yne-3,17-diol; 13-Ethyl-17α-ethynylgona-1,3,5(10)-triene-3,17β-diol;
IUPAC Name
13-ethyl-17-ethynyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Canonical SMILES
CCC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
InChI Key
VDKWHNVDYOVIIX-UHFFFAOYSA-N
Exact Mass
310.19300
H-Bond Acceptor
2
H-Bond Donor
2
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