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13'-hydroxy-gama-tocopherol
MNXM163114 is deprecated and replaced by MNXM33319
| Properties | Image | Occurences in reactions |
MNX_ID | MNXM33319 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
4 |
|
formula | C28H48O3 |
charge | 0 |
mass | 432.36035 |
reference | biggM:CE5655 |
InChIKey | QNBPVJMQPAQXML-SLGTZZLGSA-N |
InChI | InChI=1S/C28H48O3/c1-20(12-8-13-22(3)19-29)10-7-11-21(2)14-9-16-28(6)17-15-25-18-26(30)23(4)24(5)27(25)31-28/h18,20-22,29-30H,7-17,19H2,1-6H3/t20-,21+,22?,28-/m1/s1 |
SMILES | Cc1c(O)cc2c(c1C)O[C@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)CO)CC2 |
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Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
Identifier | Description |
bigg.metabolite:CE5655 biggM:CE5655
| 13'-hydroxy-gama-tocopherol
|
hmdb:HMDB0012561
| 13'-Hydroxy-gamma-tocopherol (2R)-2-[(4S,8R)-13-hydroxy-4,8,12-trimethyltridecyl]-2,7,8-trimethyl-3,4-dihydro-1-benzopyran-6-ol (2R)-2-[(4S,8R)-13-hydroxy-4,8,12-trimethyltridecyl]-2,7,8-trimethyl-3,4-dihydro-2H-1-benzopyran-6-ol 13'-Hydroxy-g-tocopherol 13'-OH-Tocopherol
|
hmdb:HMDB12561 biggM:M_CE5655
| secondary/obsolete/fantasy identifier
|