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CHEBI:32097 - Riboflavin butyrate

ChEBI IDCHEBI:32097
ChEBI NameRiboflavin butyrate
Stars
Last Modified16 May 2018
DownloadsMolfile
FormulaC33H44N4O10
Net Charge0
Average Mass656.733
Monoisotopic Mass656.30574
SMILESCCCC(=O)OC[C@@H](OC(=O)CCC)[C@@H](OC(=O)CCC)[C@H](Cn1c2nc(=O)nc(=O)c-2nc2cc(C)c(C)cc21)OC(=O)CCC
InChIInChI=1S/C33H44N4O10/c1-7-11-25(38)44-18-24(46-27(40)13-9-3)30(47-28(41)14-10-4)23(45-26(39)12-8-2)17-37-22-16-20(6)19(5)15-21(22)34-29-31(37)35-33(43)36-32(29)42/h15-16,23-24,30H,7-14,17-18H2,1-6H3,(H,36,42,43)/t23-,24+,30-/m0/s1
InChIKeyMJNIWUJSIGSWKK-BBANNHEPSA-N
ChEBI Ontology
Outgoing Relation(s)
Riboflavin butyrate (CHEBI:32097) is a flavin (CHEBI:30527)
Synonym  Source
Riboflavin butyrateKEGG COMPOUND
Manual XrefsDatabases
D01913KEGG DRUG
Registry NumbersSources
CAS:752-56-7KEGG COMPOUND