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L-histidinate(2-)
MNXM728101 is deprecated and here replaced by MNXM1107767
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM1107767 |
 |
| reference | chebi:32511 |
| formula | C6H7N3O2 |
| global charge | -2 |
| mol weight | 153.141 |
| InChIKey | TWRZMXZXJKNOLO-YFKPBYRVSA-L |
| InChI | InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H2,8,9,10,11)/p-2/t5-/m0/s1 |
| SMILES | N[C@@H](CC1=C[N-]C=N1)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H2,8,9,10,11)/t5-/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]([C:4]1=[CH:2][N:8]=[CH:3][N-:9]1)[C@@H:5]([C:6](=[O:10])[OH:11])[NH3+:7] |
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| 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
| Identifier | Description |
|---|
CHEBI:32511
chebi:32511
TWRZMXZXJKNOLO-YFKPBYRVSA-L
| L-histidinate(2-)
(2S)-2-amino-3-imidazol-1-id-4-ylpropanoate
L-histidinate
L-histidine dianion
|