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DPA-713
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical structure
DPA-713.png
1,252 × 1,084; 18 KB
0 references
mass
366.20557607200004
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₆N₄O₂
0 references
canonical SMILES
CCN(CC)C(=O)CC1=C2N=C(C=C(N2N=C1C3=CC=C(C=C3)OC)C)C
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Identifiers
InChI
InChI=1S/C21H26N4O2/c1-6-24(7-2)19(26)13-18-20(16-8-10-17(27-5)11-9-16)23-25-15(4)12-14(3)22-21(18)25/h8-12H,6-7,13H2,1-5H3
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InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
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CAS Registry Number
386297-97-8
1 reference
InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=386297-97-8
PubChem CID
11595759
1 reference
matched by identifier from
InChIKey
InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
UniChem compound ID
20372
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001126663
1 reference
matched by identifier from
InChIKey
InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0259641
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
UNII
PQF723MLIV
1 reference
matched by identifier from
InChIKey
InChIKey
ILZWUAWCTNWSFZ-UHFFFAOYSA-N
Freebase ID
/m/0k0qlq7
0 references
Microsoft Academic ID
2779375194
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enwiki
DPA-713
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