Details
Stereochemistry | ACHIRAL |
Molecular Formula | C23H24FN6O9P.2Na.6H2O |
Molecular Weight | 732.5148 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.O.O.[Na+].[Na+].COC1=CC(NC2=NC=C(F)C(NC3=NC4=C(OC(C)(C)C(=O)N4COP([O-])([O-])=O)C=C3)=N2)=CC(OC)=C1OC
InChI
InChIKey=ZQGJCHHKJNSPMS-UHFFFAOYSA-L
InChI=1S/C23H26FN6O9P.2Na.6H2O/c1-23(2)21(31)30(11-38-40(32,33)34)20-14(39-23)6-7-17(28-20)27-19-13(24)10-25-22(29-19)26-12-8-15(35-3)18(37-5)16(9-12)36-4;;;;;;;;/h6-10H,11H2,1-5H3,(H2,32,33,34)(H2,25,26,27,28,29);;;6*1H2/q;2*+1;;;;;;/p-2
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
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 | C23H26FN6O9P |
Molecular Weight | 580.4595 |
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 15:43:11 UTC 2023
by
admin
on
Fri Dec 15 15:43:11 UTC 2023
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Record UNII |
86EEZ49YVB
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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 |
C1967
Created by
admin on Fri Dec 15 15:43:11 UTC 2023 , Edited by admin on Fri Dec 15 15:43:11 UTC 2023
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FDA ORPHAN DRUG |
487715
Created by
admin on Fri Dec 15 15:43:11 UTC 2023 , Edited by admin on Fri Dec 15 15:43:11 UTC 2023
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SUB32625
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SUB197641
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C69128
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24828759
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DBSALT002691
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100000183257
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TT-74
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m5557
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86EEZ49YVB
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CHEMBL2103830
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914295-16-2
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2055929
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DTXSID10919735
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admin on Fri Dec 15 15:43:11 UTC 2023 , Edited by admin on Fri Dec 15 15:43:11 UTC 2023
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Related Record | Type | Details | ||
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SALT/SOLVATE -> SALT/SOLVATE |
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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