Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C23H27ClN2O8S |
| Molecular Weight | 526.987 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
| Stereo Comments | Stereochemistry at sulfoxide unknown |
SHOW SMILES / InChI
SMILES
CN(C)CCCN1C2=CC(Cl)=CC=C2[S+]([O-])C3=C1C=CC(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)=C3
InChI
InChIKey=RCPGKHCGDNTZFC-GUOZVAJKSA-N
InChI=1S/C23H27ClN2O8S/c1-25(2)8-3-9-26-14-6-5-13(11-17(14)35(32)16-7-4-12(24)10-15(16)26)33-23-20(29)18(27)19(28)21(34-23)22(30)31/h4-7,10-11,18-21,23,27-29H,3,8-9H2,1-2H3,(H,30,31)/t18-,19-,20+,21-,23+,35?/m0/s1
| Molecular Formula | C23H27ClN2O8S |
| Molecular Weight | 526.987 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 21:47:41 GMT 2025
by
admin
on
Tue Apr 01 21:47:41 GMT 2025
|
| Record UNII |
WC539X9GR2
|
| Record Status |
Validated (UNII)
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| Record Version |
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WC539X9GR2
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52247-95-7
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admin on Tue Apr 01 21:47:41 GMT 2025 , Edited by admin on Tue Apr 01 21:47:41 GMT 2025
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DTXSID901116152
Created by
admin on Tue Apr 01 21:47:41 GMT 2025 , Edited by admin on Tue Apr 01 21:47:41 GMT 2025
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