CHEBI:107728 - 5-(4-morpholinylsulfonyl)-1H-indole-3-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(4-morpholinylsulfonyl)-1H-indole-3-carboxylic acid
ChEBI ID CHEBI:107728
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C13H14N2O5S
Net Charge 0
Average Mass 310.327
Monoisotopic Mass 310.06234
InChI InChI=1S/C13H14N2O5S/c16-13(17)11-8-14-12-2-1-9(7-10(11)12)21(18,19)15-3-5-20-6-4-15/h1-2,7-8,14H,3-6H2,(H,16,17)
InChIKey GBSJAXQEEOQIFP-UHFFFAOYSA-N
SMILES C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)NC=C3C(=O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5-(4-morpholinylsulfonyl)-1H-indole-3-carboxylic acid (CHEBI:107728) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-19106 LINCS
View more database links