Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H25N3O5S.CO3.2Na |
Molecular Weight | 489.451 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[O-]C([O-])=O.[H][C@]12[C@@H](C)C(S[C@@H]3CN[C@@H](C3)C(=O)N(C)C)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O
InChI
InChIKey=SGVRKQURIVADFJ-OBZXMJSBSA-L
InChI=1S/C17H25N3O5S.CH2O3.2Na/c1-7-12-11(8(2)21)16(23)20(12)13(17(24)25)14(7)26-9-5-10(18-6-9)15(22)19(3)4;2-1(3)4;;/h7-12,18,21H,5-6H2,1-4H3,(H,24,25);(H2,2,3,4);;/q;;2*+1/p-2/t7-,8-,9+,10+,11-,12-;;;/m1.../s1
Molecular Formula | CO3 |
Molecular Weight | 60.0089 |
Charge | -2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C17H25N3O5S |
Molecular Weight | 383.463 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 6 / 6 |
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
Sat Dec 16 18:16:46 UTC 2023
by
admin
on
Sat Dec 16 18:16:46 UTC 2023
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Record UNII |
6LJ3NWM7AZ
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Record Status |
Validated (UNII)
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Record Version |
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-
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6LJ3NWM7AZ
Created by
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127258876
Created by
admin on Sat Dec 16 18:16:47 UTC 2023 , Edited by admin on Sat Dec 16 18:16:47 UTC 2023
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300000017633
Created by
admin on Sat Dec 16 18:16:47 UTC 2023 , Edited by admin on Sat Dec 16 18:16:47 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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