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
[H][C@@]4(OC1=CC=C2N(CCCN(C)C)C3=C(C=CC(Cl)=C3)[S+]([O-])C2=C1)O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O
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
Approval Year
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156028135
Created by
admin on Sat Dec 16 13:57:09 GMT 2023 , Edited by admin on Sat Dec 16 13:57:09 GMT 2023
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WC539X9GR2
Created by
admin on Sat Dec 16 13:57:09 GMT 2023 , Edited by admin on Sat Dec 16 13:57:09 GMT 2023
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52247-95-7
Created by
admin on Sat Dec 16 13:57:09 GMT 2023 , Edited by admin on Sat Dec 16 13:57:09 GMT 2023
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DTXSID901116152
Created by
admin on Sat Dec 16 13:57:09 GMT 2023 , Edited by admin on Sat Dec 16 13:57:09 GMT 2023
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PRIMARY |
PARENT (METABOLITE)
SUBSTANCE RECORD