Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C14H18N4O3.H2O4S |
Molecular Weight | 678.714 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.COC1=CC(CC2=C(N)N=C(N)N=C2)=CC(OC)=C1OC.COC3=CC(CC4=C(N)N=C(N)N=C4)=CC(OC)=C3OC
InChI
InChIKey=UILMMYFRNCCPLK-UHFFFAOYSA-N
InChI=1S/2C14H18N4O3.H2O4S/c2*1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;1-5(2,3)4/h2*5-7H,4H2,1-3H3,(H4,15,16,17,18);(H2,1,2,3,4)
Molecular Formula | H2O4S |
Molecular Weight | 98.078 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C14H18N4O3 |
Molecular Weight | 290.3177 |
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 15:22:34 UTC 2023
by
admin
on
Fri Dec 15 15:22:34 UTC 2023
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Record UNII |
E377MF8EQ8
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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 |
C255
Created by
admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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64936
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E377MF8EQ8
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U-99
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E377MF8EQ8
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admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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221176
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admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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100000077297
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DTXSID40205138
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56585-33-2
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admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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CHEMBL22
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admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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C48028
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admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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SUB15618MIG
Created by
admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 UTC 2023
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DBSALT001471
Created by
admin on Fri Dec 15 15:22:35 UTC 2023 , Edited by admin on Fri Dec 15 15:22:35 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 |