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CHEBI:27447 - (S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl ester

Default Structure
ChEBI IDCHEBI:27447
ChEBI Name(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl ester
Stars
Secondary ChEBI IDsCHEBI:432, CHEBI:18765
Last Modified25 October 2017
DownloadsMolfile
FormulaC24H26N2O7S
Net Charge0
Average Mass486.546
Monoisotopic Mass486.14607
SMILESCC(=O)SCC1C(c2ccc3c(c2)OCO3)C[C@@H](C(=O)NCC(=O)OCc2ccccc2)N1O
InChIInChI=1S/C24H26N2O7S/c1-15(27)34-13-20-18(17-7-8-21-22(9-17)33-14-32-21)10-19(26(20)30)24(29)25-11-23(28)31-12-16-5-3-2-4-6-16/h2-9,18-20,30H,10-14H2,1H3,(H,25,29)/t18?,19-,20?/m0/s1
InChIKeyHGABMNDIYGDWKT-GPJFCIFZSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl ester (CHEBI:27447) is a glycine derivative (CHEBI:24373)
Synonyms  Source
(S)-N-[3-(3,4-methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl esterChEBI
(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(acetylthio)methyl-1-oxoprolyl]glycine benzyl esterKEGG COMPOUND
Manual XrefsDatabases
C01315KEGG COMPOUND
C01315KEGG COMPOUND