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(Q76009669)
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Norhyoscine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Nor Scopolamine
1 reference
based on heuristic
inferred from SMILES
mass
289.131408088
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(1R,2R,4S,5S,7S)-3-oxa-9-azatricyclo[3.3.1.0²,⁴]nonan-7-yl (2R)-3-hydroxy-2-phenylpropanoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₉NO₄
0 references
canonical SMILES
O=C(OC1CC2NC(C1)C1OC21)C(CO)c1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1[C@@H]2[C@@H]3[C@@H](O3)[C@@H](N2)CC1OC(=O)[C@H](CO)C4=CC=CC=C4
0 references
Identifiers
InChI
InChI=1S/C16H19NO4/c18-8-11(9-4-2-1-3-5-9)16(19)20-10-6-12-14-15(21-14)13(7-10)17-12/h1-5,10-15,17-18H,6-8H2/t10?,11-,12-,13+,14-,15+/m1/s1
0 references
InChIKey
MOYZEMOPQDTDHA-YQYZCKNZSA-N
0 references
CAS Registry Number
4684-28-0
0 references
PubChem CID
92989
0 references
UniChem compound ID
63144991
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30963679
0 references
DSSTOX compound identifier
DTXCID701391419
0 references
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