Details
Stereochemistry | ACHIRAL |
Molecular Formula | C15H11N3O2.H2O |
Molecular Weight | 283.282 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.CC1=NC2=CC=C3N=C(NC3=C2C(O)=C1)C4=CC=CO4
InChI
InChIKey=ICNOCAYNXHYQDZ-UHFFFAOYSA-N
InChI=1S/C15H11N3O2.H2O/c1-8-7-11(19)13-9(16-8)4-5-10-14(13)18-15(17-10)12-3-2-6-20-12;/h2-7H,1H3,(H,16,19)(H,17,18);1H2
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C15H11N3O2 |
Molecular Weight | 265.2667 |
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 16:05:08 UTC 2023
by
admin
on
Fri Dec 15 16:05:08 UTC 2023
|
Record UNII |
9745E7HEBG
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
Name | Type | Language | ||
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Official Name | English | ||
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Code | English | ||
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Systematic Name | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C250
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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Code System | Code | Type | Description | ||
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58503-80-3
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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9745E7HEBG
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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CHEMBL2104697
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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DTXSID70207226
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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71587194
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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100000084482
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY | |||
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C72146
Created by
admin on Fri Dec 15 16:05:08 UTC 2023 , Edited by admin on Fri Dec 15 16:05:08 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |