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English
17-(2-Hydroxy-2-phenylethyl)morphinan-3-ol--hydrogen chloride (1/1)
group of stereoisomers with the chemical formula C₂₄H₃₀ClNO₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
399.19650687999996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₃₀ClNO₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Cl.Oc1ccc2c(c1)C13CCCCC1C(C2)N(CC(O)c1ccccc1)CC3
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
Cl.Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CC(O)c1ccccc1)CC3
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C24H29NO2.ClH/c26-19-10-9-18-14-22-20-8-4-5-11-24(20,21(18)15-19)12-13-25(22)16-23(27)17-6-2-1-3-7-17;/h1-3,6-7,9-10,15,20,22-23,26-27H,4-5,8,11-14,16H2;1H/t20-,22+,23?,24+;/m0./s1
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InChIKey
GKDHNCOWIDRBOR-LSHSPPPCSA-N
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CAS Registry Number
63732-86-5
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PubChem CID
5486017
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
54790864
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60980238
0 references
DSSTOX compound identifier
DTXCID001407516
0 references
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