Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C22H22N6O7S2 |
| Molecular Weight | 546.576 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(O\N=C(/C(=O)N[C@H]1[C@H]2SC=C(C[N+]3=CC=CC=C3)C(N2C1=O)C([O-])=O)C4=CSC(N)=N4)C(O)=O
InChI
InChIKey=LRKHKETXQNDOKF-YTAHGSIGSA-N
InChI=1S/C22H22N6O7S2/c1-22(2,20(33)34)35-26-13(12-10-37-21(23)24-12)16(29)25-14-17(30)28-15(19(31)32)11(9-36-18(14)28)8-27-6-4-3-5-7-27/h3-7,9-10,14-15,18H,8H2,1-2H3,(H4-,23,24,25,29,31,32,33,34)/b26-13-/t14-,15?,18-/m1/s1
| Molecular Formula | C22H22N6O7S2 |
| Molecular Weight | 546.576 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:29:36 GMT 2025
by
admin
on
Mon Mar 31 21:29:36 GMT 2025
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| Record UNII |
97OBN5O836
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| Record Status |
Validated (UNII)
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| Record Version |
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97OBN5O836
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1000980-60-8
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DTXSID60142935
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23659635
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1098129
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