| Properties | Image |
| MNX_ID | MNXM1130783 |
 |
| reference | lipidmapsM:LMFA08040068 |
| formula | C22H35NO3 |
| global charge | 0 |
| mol weight | 361.526 |
| InChIKey | PVTVBNICUOQEDT-JPURVOHMSA-N |
| InChI | InChI=1S/C22H35NO3/c1-2-20-21(26-20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-22(25)23-18-19-24/h3,5-6,8-9,11-12,14,20-21,24H,2,4,7,10,13,15-19H2,1H3,(H,23,25)/b5-3-,8-6-,11-9-,14-12- |
| SMILES | CCC1OC1C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO |
MNX internals
| InChI (mnx) | InChI=1/C22H35NO3/c1-2-20-21(26-20)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-22(25)23-18-19-24/h3,5-6,8-9,11-12,14,20-21,24H,2,4,7,10,13,15-19H2,1H3,(H,23,25)/b5-3-,8-6-,11-9-,14-12-/t20?,21? |
 |
| SMILES (mnx) | [CH3:1][CH2:2][CH:20]1[CH:21]([CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4]/[CH:3]=[CH:5]\[CH2:7]/[CH:9]=[CH:11]\[CH2:13][CH2:15][CH2:17][C:22](=[N:23][CH2:18][CH2:19][OH:24])[OH:25])[O:26]1 |
|