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cysteine tryptophylquinone residue
MNXM48303 is deprecated and here replaced by MNXM735000
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM735000 |
 |
| reference | chebi:20252 |
| formula | C14H11N3O4S*4 |
| global charge | 0 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]N[C@@H](CSC1=CC(=O)C(=O)C2=C1C(C[C@H](N[*])C([*])=O)=CN2)C([*])=O |
MNX internals
| InChI (mnx) | InChI=1/C18H23N3O4S/c1-9(22)12(19-3)5-11-7-21-17-16(11)15(6-14(24)18(17)25)26-8-13(20-4)10(2)23/h6-7,12-13,19-21H,5,8H2,1-4H3/t12-,13-/m0/s1/i1+1,2+1,3+1,4+1 |
 |
| SMILES (mnx) | [13CH3:1][C:9]([C@H:12]([CH2:5][C:11]1=[CH:7][NH:21][C:17]2=[C:16]1[C:15]([S:26][CH2:8][C@@H:13]([C:10]([13CH3:2])=[O:23])[NH:20][13CH3:4])=[CH:6][C:14](=[O:24])[C:18]2=[O:25])[NH:19][13CH3:3])=[O:22] |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
0 |
|