General Information of the Compound
Compound ID |
CP0044854
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Compound Name |
METHYLTRIENOLONE
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Synonyms |
[3H]-R1881
(17BETA)-17-HYDROXY-17-METHYLESTRA-4,9,11-TRIEN-3-ONE
17-beta-Hydroxy-17-methylestra-4,9,11-trien-3-one
17-beta-hydroxy-17-methylestra-4,9,11-trien-3-one (9CI)
17-methyloestra-4,9,11-trien-3-one,17beta-ol
17alpha-Methyltrienolone
17beta-Hydroxy-17-methylestra-4,9,11-trien-3-one
2C323EGI97
965-93-5
CHEBI:379896
Estra-4,9,11-trien-3-one, 17-hydroxy-17-methyl-, (17b)-
METRIBOLONE
Methyltrienolone
Metribolona
Metribolonum
R 1881
R-1881
R1881
R1881 (synthetic androgen)
RU 1881
Ru-1881
UNII-2C323EGI97
[3H]R1881
[3H]methyltrienolone
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Structure |
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Formula |
C19H24O2
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Molecular Weight |
284.399
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Canonical SMILES |
C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@]12C
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InChI |
InChI=1S/C19H24O2/c1-18-9-7-15-14-6-4-13(20)11-12(14)3-5-16(15)17(18)8-10-19(18,2)21/h7,9,11,16-17,21H,3-6,8,10H2,1-2H3/t16-,17+,18+,19+/m1/s1
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InChIKey |
CCCIJQPRIXGQOE-XWSJACJDSA-N
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CAS |
965-93-5
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Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound