General Information of the Compound
| Compound ID |
CP0134389
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| Compound Name |
5alpha-androstan-3beta-OL-17-one
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| Synonyms |
(3beta,5alpha)-3-hydroxyandrostan-17-one
3-Epiandrosterone
3Beta-hydroxy-5alpha-androstan-17-one
3beta-Hydroxy-androstan-17-one
3beta-Hydroxyetioallocholan-17-one
481-29-8
5alpha-Androstan-3beta-ol-17-one
8TR252Z538
Androstan-17-one, 3-hydroxy-, (3b,5a)-
Androsterone, epi-
C19H30O2
CHEBI:541975
CHEMBL272195
EPIANDROSTERONE
Isoandrosterone
MFCD00064134
NSC 93996
QGXBDMJGAMFCBF-LUJOEAJASA-N
ST072176
UNII-8TR252Z538
d-Epiandrosterone
epi-Androsterone
epi-andosterone
iso-Androsterone
trans-Androsterone
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| Structure |
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| Formula |
C19H30O2
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| Molecular Weight |
290.447
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| Canonical SMILES |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O
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| InChI |
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,18-,19-/m0/s1
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| InChIKey |
QGXBDMJGAMFCBF-LUJOEAJASA-N
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| CAS |
481-29-8
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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
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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
Protein ID: PT02509, G-protein coupled bile acid receptor 1
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Clinical Information about the Compound