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(Q82252328)
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CTK8G3860
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
392.12196559999995
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₈H₂₀N₂O₈
0 references
canonical SMILES
CCOC(=O)CCC(NC(=O)Oc1ccccc1)C(=O)ON1C(=O)CCC1=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCOC(=O)CC[C@@H](C(=O)ON1C(=O)CCC1=O)NC(=O)OC2=CC=CC=C2
0 references
Identifiers
InChI
InChI=1S/C18H20N2O8/c1-2-26-16(23)11-8-13(17(24)28-20-14(21)9-10-15(20)22)19-18(25)27-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,19,25)/t13-/m0/s1
0 references
InChIKey
JPMPTSKUYUOJDQ-ZDUSSCGKSA-N
0 references
CAS Registry Number
39538-31-3
0 references
PubChem CID
10222100
1 reference
matched by identifier from
InChIKey
InChIKey
JPMPTSKUYUOJDQ-ZDUSSCGKSA-N
UniChem compound ID
33597549
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70436973
1 reference
matched by identifier from
InChIKey
InChIKey
JPMPTSKUYUOJDQ-ZDUSSCGKSA-N
DSSTOX compound identifier
DTXCID50387797
0 references
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