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CHEBI:7039 - Mycosporine

ChEBI IDCHEBI:7039
ChEBI NameMycosporine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H19NO6
Net Charge0
Average Mass261.274
Monoisotopic Mass261.12124
SMILESCOC1=C(NC(CO)CO)C[C@@](O)(CO)CC1=O
InChIInChI=1S/C11H19NO6/c1-18-10-8(12-7(4-13)5-14)2-11(17,6-15)3-9(10)16/h7,12-15,17H,2-6H2,1H3/t11-/m0/s1
InChIKeyVVTDHOIRNPCGTH-NSHDSACASA-N
ChEBI Ontology
Outgoing Relation(s)
Mycosporine (CHEBI:7039) is a tertiary alcohol (CHEBI:26878)
Synonym  Source
MycosporineKEGG COMPOUND
Manual XrefsDatabases
C10607KEGG COMPOUND
C00002352KNApSAcK
Registry NumbersSources
CAS:59719-29-8KEGG COMPOUND