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S-glutathionyl-ethacrynic-acid

PropertiesImageOccurences in reactions
MNX_IDMNXM162248Image of MNXM162248
#reac
in my sandbox 0
in MNXref (generic)56
in models (compartimentalized) 56
formulaC23H27Cl2N3O9S
charge0
mass591.08451
referencebiggM:HC02201
InChIKeyBIJQYNCUDQBFTN-KBPBESRZSA-N
InChIInChI=1S/C23H27Cl2N3O9S/c1-3-11(2)21(33)12-4-6-15(20(25)19(12)24)37-9-18(32)38-10-14(22(34)27-8-17(30)31)28-16(29)7-5-13(26)23(35)36/h4,6,13-14H,2-3,5,7-10,26H2,1H3,(H,27,34)(H,28,29)(H,30,31)(H,35,36)/t13-,14-/m0/s1
SMILESC=C(CC)C(=O)c1ccc(OCC(=O)SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)c(Cl)c1Cl
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Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:HC02201
biggM:HC02201
S-glutathionyl-ethacrynic-acid
biggM:M_HC02201 secondary/obsolete/fantasy identifier