Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H23N5O.2H3O4P |
Molecular Weight | 569.4413 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.OP(O)(O)=O.CC1(C)CNC2=C1C=CC(NC(=O)C3=CC=CN=C3NCC4=CC=NC=C4)=C2
InChI
InChIKey=ONDPWWDPQDCQNJ-UHFFFAOYSA-N
InChI=1S/C22H23N5O.2H3O4P/c1-22(2)14-26-19-12-16(5-6-18(19)22)27-21(28)17-4-3-9-24-20(17)25-13-15-7-10-23-11-8-15;2*1-5(2,3)4/h3-12,26H,13-14H2,1-2H3,(H,24,25)(H,27,28);2*(H3,1,2,3,4)
Molecular Formula | C22H23N5O |
Molecular Weight | 373.4509 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | H3O4P |
Molecular Weight | 97.9952 |
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 17:20:55 UTC 2023
by
admin
on
Fri Dec 15 17:20:55 UTC 2023
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Record UNII |
T6Q3060U91
|
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 |
C1967
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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FDA ORPHAN DRUG |
197104
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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Code System | Code | Type | Description | ||
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100000124320
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CHEMBL572881
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admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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SS-23
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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DTXSID30235080
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admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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T6Q3060U91
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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C519562
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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SUB32098
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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C48374
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admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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857876-30-3
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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16097729
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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m7636
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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PRIMARY | Merck Index | ||
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DBSALT001987
Created by
admin on Fri Dec 15 17:20:55 UTC 2023 , Edited by admin on Fri Dec 15 17:20:55 UTC 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |