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English
(5alpha,17alpha)-17-Hydroxyestran-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
estrane steroid
1 reference
based on heuristic
inferred from SMILES
mass
276.208930136
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
5α-dihydronandrolone
1 reference
based on heuristic
inferred from InChI
17beta-hydroxy-5beta-estran-3-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₂₈O₂
0 references
canonical SMILES
CC12CCC3C4CCC(=O)CC4CCC3C1CCC2O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CC[C@@H]4[C@@H]3CCC(=O)C4
0 references
Identifiers
InChI
InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11,13-17,20H,2-10H2,1H3/t11-,13-,14+,15+,16-,17+,18-/m0/s1
0 references
InChIKey
RHVBIEJVJWNXBU-PUQYTDRFSA-N
0 references
CAS Registry Number
22786-93-2
0 references
PubChem CID
71749000
1 reference
matched by identifier from
InChIKey
InChIKey
RHVBIEJVJWNXBU-PUQYTDRFSA-N
UniChem compound ID
9134766
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30857761
1 reference
matched by identifier from
InChIKey
InChIKey
RHVBIEJVJWNXBU-PUQYTDRFSA-N
DSSTOX compound identifier
DTXCID40808502
0 references
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