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CHEBI:181708 - (4-Oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate

ChEBI IDCHEBI:181708
ChEBI Name(4-Oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27NO5
Net Charge0
Average Mass301.383
Monoisotopic Mass301.18892
SMILESCC(C)C(O)(C(=O)OCC1CC[N+]2([O-])CCCC12)C(C)O
InChIInChI=1S/C15H27NO5/c1-10(2)15(19,11(3)17)14(18)21-9-12-6-8-16(20)7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3
InChIKeyDLNWZIVYKQXLTN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(4-Oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate (CHEBI:181708) is a pyrrolizines (CHEBI:38522)
IUPAC Name 
(4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
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