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5-hydroxyindole thiazolidine carboxylate

PropertiesImage
MNX_IDMNXM14880 Image of MNXM14880
referencemetacycM:CPD-11670
formulaC13H13N2O3S
global charge-1
mol weight277.325
InChIKeyDFSPELNJAJEWOM-UHFFFAOYSA-M
InChIInChI=1S/C13H14N2O3S/c16-8-1-2-10-9(4-8)7(5-14-10)3-12-15-11(6-19-12)13(17)18/h1-2,4-5,11-12,14-16H,3,6H2,(H,17,18)/p-1
SMILESO=C([O-])C1CSC(CC2=CNC3=CC=C(O)C=C23)N1
MNX internals
InChI (mnx)InChI=1/C13H14N2O3S/c16-8-1-2-10-9(4-8)7(5-14-10)3-12-15-11(6-19-12)13(17)18/h1-2,4-5,11-12,14-16H,3,6H2,(H,17,18)/t11?,12? Image of MNXM14880
SMILES (mnx)[CH:1]1=[CH:2][C:10]2=[C:9]([CH:4]=[C:8]1[OH:16])[C:7]([CH2:3][CH:12]1[NH:15][CH:11]([C:13](=[O:17])[OH:18])[CH2:6][S:19]1)=[CH:5][NH:14]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-11670
metacycM:CPD-11670
seed.compound:cpd23048
seedM:cpd23048
DFSPELNJAJEWOM-UHFFFAOYSA-M 		5-hydroxyindole thiazolidine carboxylate
5-hydroxyindole thiazolidine carboxylic acid
hmdb:HMDB0304217
DFSPELNJAJEWOM-UHFFFAOYSA-N 		5-hydroxyindole thiazolidine carboxylate
2-(3'-(5'-Hydroxyindolyl)methyl)-1,3-thiazolidine-4-carboxylic acid
2-[(5-Hydroxy-1H-indol-3-yl)methyl]-1,3-thiazolidine-4-carboxylate
2-[(5-hydroxy-1H-indol-3-yl)methyl]-1,3-thiazolidine-4-carboxylic acid
5-Hydroxyindole thiazolidine carboxylic acid

seedM:M_cpd23048 		secondary/obsolete/fantasy identifier