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AMISULPRIDE-MET 48 -724
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Keyword(s):
Surfactants
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SubStructure
Threshold (%) >=
70
Structure
InChI Key
QVRAYVUZIYBLCJ-UHFFFAOYSA-N
Smiles
S(=O)(c1c(N)cc(OC)c(C(NCC2N(C3C(C(C(C(O3)C(O)=O)O)O)O)(C4C(C(C(C(O4)C(O)=O)O)O)O)(CCC2)(Cl)CC)=O)c1)(CC)=O
InChI
InChI=1S/C29H45ClN3O16S/c1-4-33(30,26-21(38)17(34)19(36)23(48-26)28(41)42,27-22(39)18(35)20(37)24(49-27)29(43)44)8-6-7-12(33)11-32-25(40)13-9-16(50(45,46)5-2)14(31)10-15(13)47-3/h9-10,12,17-24,26-27,34-39H,4-8,11,31H2,1-3H3,(H,32,40)(H,41,42)(H,43,44)
Physicochemical Descriptors
Property Name
Value
Molecular Formula
C29H45Cl1N3O16S1
Cross References
Resources
Reference
CAS NUMBER
70006-24-5
NORMAN SUSDAT
NS00000757
CONTENTS
Structure
Chemical and Physical Properties