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3-hydroxyropivacaine

PropertiesImage
MNX_IDMNXM150928 Image of MNXM150928
referencehmdb:HMDB0060962
formulaC17H26N2O2
global charge0
mol weight290.407
InChIKeyIXOVDWXTIIYVOJ-CQSZACIVSA-N
InChIInChI=1S/C17H26N2O2/c1-4-10-19-11-6-5-7-14(19)17(21)18-16-12(2)8-9-15(20)13(16)3/h8-9,14,20H,4-7,10-11H2,1-3H3,(H,18,21)/t14-/m1/s1
SMILESCCCN1CCCC[C@@H]1C(O)=NC1=C(C)C=CC(O)=C1C
MNX internals
InChI (mnx)InChI=1/C17H26N2O2/c1-4-10-19-11-6-5-7-14(19)17(21)18-16-12(2)8-9-15(20)13(16)3/h8-9,14,20H,4-7,10-11H2,1-3H3,(H,18,21)/t14-/m1/s1 Image of MNXM150928
SMILES (mnx)[CH3:1][CH2:4][CH2:10][N:19]1[CH2:11][CH2:6][CH2:5][CH2:7][C@@H:14]1[C:17](=[N:18][C:16]1=[C:12]([CH3:2])[CH:8]=[CH:9][C:15]([OH:20])=[C:13]1[CH3:3])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0060962
IXOVDWXTIIYVOJ-CQSZACIVSA-N
3-hydroxyropivacaine
(2R)-N-(3-hydroxy-2,6-dimethylphenyl)-1-propylpiperidine-2-carboximidic acid

hmdb:HMDB60962
secondary/obsolete/fantasy identifier