Feedback
phaeophytin b
MNXM75043 is deprecated and here replaced by MNXM1108361
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1108361 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
0 |
|
| formula | C55H70N4O6 |
| charge | 0 |
| mass | 882.52954 |
| reference | seedM:cpd23988 |
| InChIKey | PROTXRDBJPCNCE-ROWRJFNXSA-N |
| InChI | InChI=1S/C55H70N4O6/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42/h12,25,27-33,36,40,51H,1,13-24,26H2,2-11H3/b34-25+,42-27-,43-27?,44-28-,45-29?,46-28?,47-29-,52-50-/t32-,33-,36+,40+,51-/m1/s1 |
| SMILES | C=CC1=C(C)/C2=C/C3=N/C(=C4\C5=N/C(=C\C6=N/C(=C\C1=N2)C(C=O)=C6CC)C(C)=C5C(=O)[C@@H]4C(=O)OC)[C@@H](CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)[C@@H]3C |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
