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3-mercaptobutanoate

PropertiesImage
MNX_IDMNXM150943 Image of MNXM150943
referencemetacycM:CPD-16592
formulaC4H7O2S
global charge-1
mol weight119.165
InChIKeyRQPNXPWEGVCPCX-UHFFFAOYSA-M
InChIInChI=1S/C4H8O2S/c1-3(7)2-4(5)6/h3,7H,2H2,1H3,(H,5,6)/p-1
SMILESCC(S)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C4H8O2S/c1-3(7)2-4(5)6/h3,7H,2H2,1H3,(H,5,6)/t3? Image of MNXM150943
SMILES (mnx)[CH3:1][CH:3]([CH2:2][C:4](=[O:5])[OH:6])[SH:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-16592
metacycM:CPD-16592
seed.compound:cpd34896
seedM:cpd34896
RQPNXPWEGVCPCX-UHFFFAOYSA-M
3-mercaptobutanoate
3-mercaptobutanoic acid
3-mercaptobutyrate
3-thiobutanoic acid
3-thiobutyric acid

seedM:M_cpd34896
secondary/obsolete/fantasy identifier