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a catechol
MNXM181 is deprecated and here replaced by MNXM731895
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM731895 |
 |
| reference | metacycM:Catechols |
| formula | C6H2O2*4 |
| global charge | 0 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]C1=C([*])C(O)=C(O)C([*])=C1[*] |
MNX internals
| InChI (mnx) | InChI=1/C10H14O2/c1-5-6(2)8(4)10(12)9(11)7(5)3/h11-12H,1-4H3/i1+1,2+1,3+1,4+1 |
 |
| SMILES (mnx) | [13CH3:1][C:5]1=[C:6]([13CH3:2])[C:8]([13CH3:4])=[C:10]([OH:12])[C:9]([OH:11])=[C:7]1[13CH3:3] |
|
| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
0 |
|