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uroporphyrin I
MNXM9220 is deprecated and here replaced by MNXM1108551
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1108551 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C40H28N4O16 |
| charge | -8 |
| mass | 820.15442 |
| reference | metacycM:UROPORPHYRIN_I |
| InChIKey | ZRUDAKXKJCGVKT-JRHDEHKPSA-F |
| InChI | InChI=1S/C40H36N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-14-26-19(3-7-35(49)50)23(11-39(57)58)31(43-26)16-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)15-27-18(2-6-34(47)48)22(10-38(55)56)30(42-27)13-25(17)41-29/h13-16H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)/p-8/b25-13-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15- |
| SMILES | O=C([O-])CCC1=C(CC(=O)[O-])C2=N/C1=C\C1=N/C(=C\C3=N/C(=C\C4=N/C(=C\2)C(CCC(=O)[O-])=C4CC(=O)[O-])C(CCC(=O)[O-])=C3CC(=O)[O-])C(CCC(=O)[O-])=C1CC(=O)[O-] |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
