| Properties | Image |
|---|
| MNX_ID | MNXM179279 |
 |
| reference | slm:000126097 |
| formula | C45H84O6 |
| global charge | 0 |
| mol weight | 721.161 |
| InChIKey | PEVBDANCJXDAAH-PNHLSOANSA-N |
| InChI | InChI=1S/C45H84O6/c1-4-7-10-13-16-19-22-23-24-27-30-33-36-39-45(48)51-42(40-49-43(46)37-34-31-28-25-20-17-14-11-8-5-2)41-50-44(47)38-35-32-29-26-21-18-15-12-9-6-3/h24,27,42H,4-23,25-26,28-41H2,1-3H3/b27-24- |
| SMILES | CCCCCCCCC/C=C\CCCCC(=O)OC(COC(=O)CCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C45H84O6/c1-4-7-10-13-16-19-22-23-24-27-30-33-36-39-45(48)51-42(40-49-43(46)37-34-31-28-25-20-17-14-11-8-5-2)41-50-44(47)38-35-32-29-26-21-18-15-12-9-6-3/h24,27,42H,4-23,25-26,28-41H2,1-3H3/b27-24- |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:23]/[CH:24]=[CH:27]\[CH2:30][CH2:33][CH2:36][CH2:39][C:45](=[O:48])[O:51][CH:42]([CH2:40][O:49][C:43]([CH2:37][CH2:34][CH2:31][CH2:28][CH2:25][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:46])[CH2:41][O:50][C:44]([CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:47] |
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