| Properties | Image | Occurences in reactions |
MNX_ID | MNXM9139 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 2 |
in models (compartimentalized) |
7 |
|
formula | C31H51NO4 |
charge | 0 |
mass | 501.38181 |
reference | biggM:tetpent3crn |
InChIKey | AQYQJMYFFSCGBI-UHFFFAOYSA-N |
InChI | InChI=1S/C31H51NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-31(35)36-29(27-30(33)34)28-32(2,3)4/h6-7,9-10,12-13,15-16,18-19,29H,5,8,11,14,17,20-28H2,1-4H3 |
SMILES | CCC=CCC=CCC=CCC=CCC=CCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C |
|