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CHEBI:143778 - N-(C-5-[deoxy-β-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serinate

ChEBI IDCHEBI:143778
ChEBI NameN-(C-5-[deoxy-β-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serinate
Stars
ASCII NameN-(C-5-[deoxy-beta-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serinate
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC16H20NO11
Net Charge-1
Average Mass402.332
Monoisotopic Mass402.10418
SMILESO=C(N[C@@H](CO)C(=O)[O-])c1cc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1O
InChIInChI=1S/C16H21NO11/c18-3-7(16(26)27)17-15(25)6-1-5(2-8(20)10(6)21)14-13(24)12(23)11(22)9(4-19)28-14/h1-2,7,9,11-14,18-24H,3-4H2,(H,17,25)(H,26,27)/p-1/t7-,9+,11+,12-,13+,14-/m0/s1
InChIKeyDZGUVNHTZMXFAA-SKLLSKDGSA-M
ChEBI Ontology
Outgoing Relation(s)
N-(C-5-[deoxy-β-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serinate (CHEBI:143778) has functional parent L-serine zwitterion (CHEBI:33384)
N-(C-5-[deoxy-β-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serinate (CHEBI:143778) is a organic anion (CHEBI:25696)
Synonym  Source
salmochelin SXSUBMITTER
UniProt Name  Source
N-(C-5-[deoxy-β-D-glucosyl]-2,3-dihydroxybenzoyl)-L-serineUniProt