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CHEBI:182797 - [3-Methyl-1-[3-methyl-1-oxo-1-(2,3,4,5,6-pentahydroxyhexoxy)pentan-2-yl]oxy-1-oxobutan-2-yl] 2-hydroxy-3-methylpentanoate

ChEBI IDCHEBI:182797
ChEBI Name[3-Methyl-1-[3-methyl-1-oxo-1-(2,3,4,5,6-pentahydroxyhexoxy)pentan-2-yl]oxy-1-oxobutan-2-yl] 2-hydroxy-3-methylpentanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H42O12
Net Charge0
Average Mass510.577
Monoisotopic Mass510.26763
SMILESCCC(C)C(O)C(=O)OC(C(=O)OC(C(=O)OCC(O)C(O)C(O)C(O)CO)C(C)CC)C(C)C
InChIInChI=1S/C23H42O12/c1-7-12(5)16(27)21(30)34-19(11(3)4)23(32)35-20(13(6)8-2)22(31)33-10-15(26)18(29)17(28)14(25)9-24/h11-20,24-29H,7-10H2,1-6H3
InChIKeyNJYYDRBRLSOFNG-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
[3-Methyl-1-[3-methyl-1-oxo-1-(2,3,4,5,6-pentahydroxyhexoxy)pentan-2-yl]oxy-1-oxobutan-2-yl] 2-hydroxy-3-methylpentanoate (CHEBI:182797) is a depsipeptide (CHEBI:23643)
IUPAC Name 
[3-methyl-1-[3-methyl-1-oxo-1-(2,3,4,5,6-pentahydroxyhexoxy)pentan-2-yl]oxy-1-oxobutan-2-yl] 2-hydroxy-3-methylpentanoate