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(2S,4R,5S)-Muscarine
MNXM62669 is deprecated and here replaced by MNXM1370586
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1370586 |
 |
reference | chebi:196009 |
formula | C9H20NO2 |
global charge | 1 |
mol weight | 174.264 |
InChIKey | UQOFGTXDASPNLL-UHFFFAOYSA-N |
InChI | InChI=1S/C9H20NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-9,11H,5-6H2,1-4H3/q+1 |
SMILES | CC1OC(C[N+](C)(C)C)CC1O |
MNX internals
InChI (mnx) | InChI=1/C9H20NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-9,11H,5-6H2,1-4H3/q+1/t7?,8?,9? |
 |
SMILES (mnx) | [CH3:1][CH:7]1[CH:9]([OH:11])[CH2:5][CH:8]([CH2:6][N+:10]([CH3:2])([CH3:3])[CH3:4])[O:12]1 |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
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Similar chemical compounds in external resources
Identifier | Description |
CHEBI:196009 chebi:196009 UQOFGTXDASPNLL-UHFFFAOYSA-N
| (2S,4R,5S)-Muscarine (4-hydroxy-5-methyloxolan-2-yl)methyl-trimethylazanium
|
hmdb:HMDB0029936 UQOFGTXDASPNLL-UHFFFAOYSA-N
| (2S,4R,5S)-Muscarine (+)-(2S,4R,5S)-Muscarine (+)-Muscarine L-(+)-Muscarine Muscarin Muscarine Muscarine (alkaloid) Muscarine (the alkaloid) Muscarine II Muscarine chloride Muskarin Trimethyl(tetrahydro-4-hydroxy-5-methylfurfuryl)-ammonium [(4-hydroxy-5-methyloxolan-2-yl)methyl]trimethylazanium
|
hmdb:HMDB29936
| secondary/obsolete/fantasy identifier
|