| Properties | Image |
|---|
| MNX_ID | MNXM192962 |
 |
| reference | slm:000128298 |
| formula | C47H88O6 |
| global charge | 0 |
| mol weight | 749.215 |
| InChIKey | ALGMTANOGYTBDE-ZYRKPHGJSA-N |
| InChI | InChI=1S/C47H88O6/c1-4-7-10-13-16-19-21-22-23-24-26-28-31-34-37-40-46(49)52-43-44(42-51-45(48)39-36-33-30-27-18-15-12-9-6-3)53-47(50)41-38-35-32-29-25-20-17-14-11-8-5-2/h19,21,44H,4-18,20,22-43H2,1-3H3/b21-19+/t44-/m0/s1 |
| SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C47H88O6/c1-4-7-10-13-16-19-21-22-23-24-26-28-31-34-37-40-46(49)52-43-44(42-51-45(48)39-36-33-30-27-18-15-12-9-6-3)53-47(50)41-38-35-32-29-25-20-17-14-11-8-5-2/h19,21,44H,4-18,20,22-43H2,1-3H3/b21-19+/t44-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16]/[CH:19]=[CH:21]/[CH2:22][CH2:23][CH2:24][CH2:26][CH2:28][CH2:31][CH2:34][CH2:37][CH2:40][C:46](=[O:49])[O:52][CH2:43][C@H:44]([CH2:42][O:51][C:45]([CH2:39][CH2:36][CH2:33][CH2:30][CH2:27][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:48])[O:53][C:47]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:25][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:50] |
|