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English
Estra-1(10),2,4-triene-3,17-diol
group of stereoisomers with the chemical formula C₁₈H₂₄O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
272.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₄O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC12CCC3c4ccc(O)cc4CCC3C1CCC2O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC12CCC3c4ccc(O)cc4CC[C@@H]3C1CC[C@@H]2O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14?,15-,16?,17-,18?/m0/s1
0 references
InChIKey
VOXZDWNPVJITMN-ZZEXBNFBSA-N
0 references
CAS Registry Number
517-04-4
0 references
PubChem CID
10596
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
VOXZDWNPVJITMN-ZZEXBNFBSA-N
UniChem compound ID
47018072
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00965968
1 reference
matched by identifier from
InChIKey
InChIKey
VOXZDWNPVJITMN-ZZEXBNFBSA-N
DSSTOX compound identifier
DTXCID201393622
0 references
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