Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C10H12N5O14P3.4Na |
Molecular Weight | 611.1077 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].NC1=NC2=C(N=CN2[C@@H]3O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)[C@@H](O)[C@H]3O)C(=O)N1
InChI
InChIKey=XCSVCFZQFRBYFA-ZVQJTLEUSA-J
InChI=1S/C10H16N5O14P3.4Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21;;;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18);;;;/q;4*+1/p-4/t3-,5-,6-,9-;;;;/m1..../s1
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 | C10H12N5O14P3 |
Molecular Weight | 519.1487 |
Charge | -4 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL5681 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8573186 |
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Target ID: Q9Y3Z3 Gene ID: 25939.0 Gene Symbol: SAMHD1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/23880768 |
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Target ID: Ras-like GTPases Sources: https://www.ncbi.nlm.nih.gov/pubmed/15236956 |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:41:49 GMT 2023
by
admin
on
Sat Dec 16 11:41:49 GMT 2023
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Record UNII |
QV292CDK29
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Record Status |
Validated (UNII)
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Record Version |
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-
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QV292CDK29
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DTXSID80931949
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14356-96-8
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238-324-1
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |