Details
Stereochemistry | ACHIRAL |
Molecular Formula | C24H20N6O3 |
Molecular Weight | 440.454 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=NC2=C(N1CC3=CC=C(C=C3)C4=C(C=CC=C4)C5=NN=NN5)C(=CC=C2)C(O)=O
InChI
InChIKey=HTQMVQVXFRQIKW-UHFFFAOYSA-N
InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
Molecular Formula | C24H20N6O3 |
Molecular Weight | 440.454 |
Charge | 0 |
Count |
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Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:47:59 UTC 2023
by
admin
on
Fri Dec 15 15:47:59 UTC 2023
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Record UNII |
S8Q36MD2XX
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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WHO-VATC |
QC09DB07
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WHO-VATC |
QC09CA06
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WHO-ATC |
C09CA06
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NDF-RT |
N0000000070
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WHO-ATC |
C09DA06
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NCI_THESAURUS |
C66930
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NDF-RT |
N0000175561
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WHO-ATC |
C09DX06
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WHO-VATC |
QC09DA06
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WHO-ATC |
C09DB07
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LIVERTOX |
NBK548409
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SUB06070MIG
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m3012
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7239
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CHEMBL1016
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CANDESARTAN
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CHEMBL1014
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Candesartan
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C081643
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S8Q36MD2XX
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DB00796
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149509
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C65284
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214354
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DTXSID0022725
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3347
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1087870
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100000081620
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JJ-6
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S8Q36MD2XX
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139481-59-7
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Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
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TRANSPORTER -> INHIBITOR | |||
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TRANSPORTER -> INHIBITOR | |||
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TRANSPORTER -> INHIBITOR | |||
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BINDER->LIGAND |
BINDING
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Related Record | Type | Details | ||
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METABOLITE -> PARENT |
PLASMA; URINE
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PRODRUG -> METABOLITE ACTIVE |
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Related Record | Type | Details | ||
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IMPURITY -> PARENT |
Priority toxic pollutant.
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IMPURITY -> PARENT |
Probable human carcinogen.
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PARENT -> IMPURITY |
for the calculation of content, multiply the peak area by 0.7.
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY GENOTOXIC->PARENT |
NDMA is an organic chemical that is in a family of potent carcinogens.
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Volume of Distribution | PHARMACOKINETIC |
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Biological Half-life | PHARMACOKINETIC |
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