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12S-HHT
MNXM13995 is deprecated and here replaced by MNXM728292
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM728292 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
4 |
|
| formula | C17H26O3 |
| charge | 0 |
| mass | 278.18819 |
| reference | biggM:CE1243 |
| InChIKey | SRXHUEDHCZMBHJ-VBGPEQDQSA-N |
| InChI | InChI=1S/C17H26O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h5-8,11,13-14,18H,2-4,9-10,12,15H2,1H3,(H,19,20)/b7-5-,8-6+,14-11+,16-13? |
| SMILES | CCCCC=C(O)/C=C/C=C/C/C=C\CCCC(=O)O |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
