Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C19H21N3O.C4H6O6 |
Molecular Weight | 764.8659 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN(C)C(=O)CC1=C(N=C2C=CC(C)=CN12)C3=CC=C(C)C=C3.CN(C)C(=O)CC4=C(N=C5C=CC(C)=CN45)C6=CC=C(C)C=C6
InChI
InChIKey=VXRDAMSNTXUHFX-CEAXSRTFSA-N
InChI=1S/2C19H21N3O.C4H6O6/c2*1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19;5-1(3(7)8)2(6)4(9)10/h2*5-10,12H,11H2,1-4H3;1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C19H21N3O |
Molecular Weight | 307.3895 |
Charge | 0 |
Count |
|
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 15:11:16 UTC 2023
by
admin
on
Fri Dec 15 15:11:16 UTC 2023
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Record UNII |
WY6W63843K
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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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NCI_THESAURUS |
C29756
Created by
admin on Fri Dec 15 15:11:16 UTC 2023 , Edited by admin on Fri Dec 15 15:11:16 UTC 2023
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Code System | Code | Type | Description | ||
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221183
Created by
admin on Fri Dec 15 15:11:16 UTC 2023 , Edited by admin on Fri Dec 15 15:11:16 UTC 2023
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PRIMARY | RxNorm | ||
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WY6W63843K
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7045
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1724907
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SUB05192MIG
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CHEMBL911
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Y-28
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m11661
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PRIMARY | Merck Index | ||
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SUB127297
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C29553
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WY6W63843K
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100000091037
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DBSALT001047
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10126
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441338
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DTXSID00912795
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99294-93-6
Created by
admin on Fri Dec 15 15:11:16 UTC 2023 , Edited by admin on Fri Dec 15 15:11:16 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
|
PARENT -> SALT/SOLVATE | |||
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BASIS OF STRENGTH->SUBSTANCE |
ASSAY (TITRATION)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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Related Record | Type | Details | ||
---|---|---|---|---|
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ACTIVE MOIETY |