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(Q72507106)
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English
Scandine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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chemical formula
C₂₁H₂₂N₂O₃
0 references
canonical SMILES
CNCCc1ccc(OC(=O)C(C)C)c(OC(=O)C(C)C)c1.Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H25NO4.ClH/c1-11(2)16(19)21-14-7-6-13(8-9-18-5)10-15(14)22-17(20)12(3)4;/h6-7,10-12,18H,8-9H2,1-5H3;1H
0 references
InChIKey
ALIXRWKJZYLBJI-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
24314-59-8
0 references
PubChem CID
156320
1 reference
matched by identifier from
InChIKey
InChIKey
ALIXRWKJZYLBJI-UHFFFAOYSA-N
DSSTox substance ID
DTXSID0020864
1 reference
matched by identifier from
InChIKey
InChIKey
ALIXRWKJZYLBJI-UHFFFAOYSA-N
UNII
3VXW2HU8GS
1 reference
matched by identifier from
InChIKey
InChIKey
ALIXRWKJZYLBJI-UHFFFAOYSA-N
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