Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H21Cl2F3N5O12P3S2.4Na |
Molecular Weight | 864.287 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].CSCCNC1=C2N=CN([C@@H]3O[C@H](COP([O-])(=O)OP([O-])(=O)C(Cl)(Cl)P([O-])([O-])=O)[C@@H](O)[C@H]3O)C2=NC(SCCC(F)(F)F)=N1
InChI
InChIKey=COWWROCHWNGJHQ-OPKBHZIBSA-J
InChI=1S/C17H25Cl2F3N5O12P3S2.4Na/c1-43-5-3-23-12-9-13(26-15(25-12)44-4-2-16(20,21)22)27(7-24-9)14-11(29)10(28)8(38-14)6-37-42(35,36)39-41(33,34)17(18,19)40(30,31)32;;;;/h7-8,10-11,14,28-29H,2-6H2,1H3,(H,33,34)(H,35,36)(H,23,25,26)(H2,30,31,32);;;;/q;4*+1/p-4/t8-,10-,11-,14-;;;;/m1..../s1
Molecular Formula | C17H21Cl2F3N5O12P3S2 |
Molecular Weight | 772.327 |
Charge | -4 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:48:45 UTC 2023
by
admin
on
Fri Dec 15 15:48:45 UTC 2023
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Record UNII |
2144G00Y7W
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Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Brand Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1327
Created by
admin on Fri Dec 15 15:48:45 UTC 2023 , Edited by admin on Fri Dec 15 15:48:45 UTC 2023
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EMA ASSESSMENT REPORTS |
KENGREXAL (AUTHORIZED: VASCULAR SURGICAR PROCEDURES
Created by
admin on Fri Dec 15 15:48:45 UTC 2023 , Edited by admin on Fri Dec 15 15:48:45 UTC 2023
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EMA ASSESSMENT REPORTS |
KENGREXAL (AUTHORIZED: ACUTE CORONARY SYNDROME)
Created by
admin on Fri Dec 15 15:48:45 UTC 2023 , Edited by admin on Fri Dec 15 15:48:45 UTC 2023
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Code System | Code | Type | Description | ||
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100000168765
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DBSALT001292
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1656051
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PRIMARY | RxNorm | ||
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10260031
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163706-36-3
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RR-129
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2144G00Y7W
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C76396
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CHEMBL334966
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m3019
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PRIMARY | Merck Index | ||
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DTXSID50167652
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SUB182388
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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 |