| Properties | Image |
|---|
| MNX_ID | MNXM138260 |
 |
| reference | hmdb:HMDB0045537 |
| formula | C59H108O6 |
| global charge | 0 |
| mol weight | 913.507 |
| InChIKey | NTBCNYFEMZLAKQ-GETVJMIXSA-N |
| InChI | InChI=1S/C59H108O6/c1-4-7-10-13-16-19-22-25-27-29-31-34-36-39-42-45-48-51-57(60)63-54-56(65-59(62)53-50-47-44-41-38-33-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-37-35-32-30-28-26-23-20-17-14-11-8-5-2/h25,27,31,34,39,42,56H,4-24,26,28-30,32-33,35-38,40-41,43-55H2,1-3H3/b27-25-,34-31-,42-39-/t56-/m1/s1 |
| SMILES | CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H108O6/c1-4-7-10-13-16-19-22-25-27-29-31-34-36-39-42-45-48-51-57(60)63-54-56(65-59(62)53-50-47-44-41-38-33-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-37-35-32-30-28-26-23-20-17-14-11-8-5-2/h25,27,31,34,39,42,56H,4-24,26,28-30,32-33,35-38,40-41,43-55H2,1-3H3/b27-25-,34-31-,42-39-/t56-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:31]=[CH:34]\[CH2:36]/[CH:39]=[CH:42]\[CH2:45][CH2:48][CH2:51][C:57](=[O:60])[O:63][CH2:54][C@H:56]([CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:35][CH2:32][CH2:30][CH2:28][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:61])[O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:33][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:62] |
|