Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H20N4O9P.Na |
| Molecular Weight | 478.3256 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC1=CC2=C(C=C1C)N(C[C@H](O)[C@H](OP(O)([O-])=O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=N2
InChI
InChIKey=CBTBWMJAHGSOKL-BMZHGHOISA-M
InChI=1S/C17H21N4O9P.Na/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(23)14(12(24)6-22)30-31(27,28)29;/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29);/q;+1/p-1/t11-,12+,14-;/m0./s1
| Molecular Formula | C17H20N4O9P |
| Molecular Weight | 455.3359 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| 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
Wed Apr 02 11:49:01 GMT 2025
by
admin
on
Wed Apr 02 11:49:01 GMT 2025
|
| Record UNII |
J3R2VFC5FL
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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494789-94-5
Created by
admin on Wed Apr 02 11:49:01 GMT 2025 , Edited by admin on Wed Apr 02 11:49:01 GMT 2025
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PRIMARY | |||
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J3R2VFC5FL
Created by
admin on Wed Apr 02 11:49:01 GMT 2025 , Edited by admin on Wed Apr 02 11:49:01 GMT 2025
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PRIMARY | |||
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1388679-88-6
Created by
admin on Wed Apr 02 11:49:01 GMT 2025 , Edited by admin on Wed Apr 02 11:49:01 GMT 2025
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NON-SPECIFIC STOICHIOMETRY | |||
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155884419
Created by
admin on Wed Apr 02 11:49:01 GMT 2025 , Edited by admin on Wed Apr 02 11:49:01 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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