Details
Stereochemistry | ACHIRAL |
Molecular Formula | C19H18FN3O.H3O4P |
Molecular Weight | 421.3593 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OP(O)(O)=O.CNCC1=CC=C(C=C1)C2=C3CCNC(=O)C4=CC(F)=CC(N2)=C34
InChI
InChIKey=FCCGJTKEKXUBFZ-UHFFFAOYSA-N
InChI=1S/C19H18FN3O.H3O4P/c1-21-10-11-2-4-12(5-3-11)18-14-6-7-22-19(24)15-8-13(20)9-16(23-18)17(14)15;1-5(2,3)4/h2-5,8-9,21,23H,6-7,10H2,1H3,(H,22,24);(H3,1,2,3,4)
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 |
Molecular Formula | C19H18FN3O |
Molecular Weight | 323.3641 |
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 19:38:47 UTC 2023
by
admin
on
Fri Dec 15 19:38:47 UTC 2023
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Record UNII |
H3M9955244
|
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 |
C62554
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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Code System | Code | Type | Description | ||
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9931953
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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DBSALT001983
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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100000175670
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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C78186
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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459868-92-9
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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CHEMBL1173055
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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H3M9955244
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY | |||
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XX-95
Created by
admin on Fri Dec 15 19:38:47 UTC 2023 , Edited by admin on Fri Dec 15 19:38:47 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |