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 | 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 | C17H20N4O9P |
Molecular Weight | 455.3359 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:38:01 GMT 2023
by
admin
on
Sat Dec 16 18:38:01 GMT 2023
|
Record UNII |
J3R2VFC5FL
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Record Status |
Validated (UNII)
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Record Version |
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-
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494789-94-5
Created by
admin on Sat Dec 16 18:38:01 GMT 2023 , Edited by admin on Sat Dec 16 18:38:01 GMT 2023
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PRIMARY | |||
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J3R2VFC5FL
Created by
admin on Sat Dec 16 18:38:01 GMT 2023 , Edited by admin on Sat Dec 16 18:38:01 GMT 2023
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1388679-88-6
Created by
admin on Sat Dec 16 18:38:01 GMT 2023 , Edited by admin on Sat Dec 16 18:38:01 GMT 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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155884419
Created by
admin on Sat Dec 16 18:38:01 GMT 2023 , Edited by admin on Sat Dec 16 18:38:01 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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