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RED

Summary
Name:DIHYDROLIPOIC ACID
Formula:C8 H16 O2 S2
Formal charge:0
Formula weight:208.341 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(6R)-6,8-disulfanyloctanoic acid
OpenEye OEToolkits1.5.0(6R)-6,8-bis-sulfanyloctanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)CCCCC(S)CCS
SMILES_CANONICALCACTVS3.341OC(=O)CCCC[C@@H](S)CCS
SMILESCACTVS3.341OC(=O)CCCC[CH](S)CCS
SMILES_CANONICALOpenEye OEToolkits1.5.0C(CCC(=O)O)C[C@H](CCS)S
SMILESOpenEye OEToolkits1.5.0C(CCC(=O)O)CC(CCS)S
InChIInChI1.03InChI=1S/C8H16O2S2/c9-8(10)4-2-1-3-7(12)5-6-11/h7,11-12H,1-6H2,(H,9,10)/t7-/m1/s1
InChIKeyInChI1.03IZFHEQBZOYJLPK-SSDOTTSWSA-N

217705

PDB entries from 2024-03-27

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