| Properties | Image |
|---|
| MNX_ID | MNXM318488 |
 |
| reference | slm:000124170 |
| formula | C44H78O5 |
| global charge | 0 |
| mol weight | 687.103 |
| InChIKey | VAUSEZDMBCHPKB-WWBNRHBGSA-N |
| InChI | InChI=1S/C44H78O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-28-31-34-37-43(46)48-39-42(45)40-49-44(47)38-35-32-29-26-23-20-21-24-27-30-33-36-41(2)3/h8-9,11-12,14-15,17-18,41-42,45H,4-7,10,13,16,19-40H2,1-3H3/b9-8-,12-11-,15-14-,18-17-/t42-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C44H78O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-28-31-34-37-43(46)48-39-42(45)40-49-44(47)38-35-32-29-26-23-20-21-24-27-30-33-36-41(2)3/h8-9,11-12,14-15,17-18,41-42,45H,4-7,10,13,16,19-40H2,1-3H3/b9-8-,12-11-,15-14-,18-17-/t42-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][C:43](=[O:46])[O:48][CH2:39][C@H:42]([CH2:40][O:49][C:44]([CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][CH2:36][CH:41]([CH3:2])[CH3:3])=[O:47])[OH:45] |
|