| Properties | Image | Occurences in reactions |
MNX_ID | MNXM113622 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C22H29NO6 |
charge | 0 |
mass | 403.19949 |
reference | chebi:70287 |
InChIKey | KQURUXJOTYKSMO-ZSBVLOQZSA-N |
InChI | InChI=1S/C22H29NO6/c1-2-15(14-24)7-5-3-4-6-8-18(26)19-20(27)17(13-23-21(19)28)22(29)11-9-16(25)10-12-22/h3-8,13,15-16,24-25,29H,2,9-12,14H2,1H3,(H2,23,27,28)/b4-3+,7-5+,8-6+/t15?,16-,22+ |
SMILES | CCC(/C=C/C=C/C=C/C(=O)c1c(O)c([C@]2(O)CC[C@@H](O)CC2)c[nH]c1=O)CO |
|