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xi,xi-pilocarpine

PropertiesImage
MNX_IDMNXM13267 Image of MNXM13267
referencechebi:39460
formulaC11H16N2O2
global charge0
mol weight208.261
InChIKeyQCHFTSOMWOSFHM-UHFFFAOYSA-N
InChIInChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3
SMILESCCC1C(=O)OCC1CC1=CN=CN1C
MNX internals
InChI (mnx)InChI=1/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8?,10? Image of MNXM13267
SMILES (mnx)[CH3:1][CH2:3][CH:10]1[CH:8]([CH2:4][C:9]2=[CH:5][N:12]=[CH:7][N:13]2[CH3:2])[CH2:6][O:15][C:11]1=[O:14]
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

CHEBI:39460
chebi:39460
QCHFTSOMWOSFHM-UHFFFAOYSA-N
xi,xi-pilocarpine
3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one
hmdb:HMDB0243539
QCHFTSOMWOSFHM-UHFFFAOYSA-N
(+)-Isopilocarpine
3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]oxolan-2-one
xi,xi-pilocarpine