| Properties | Image |
|---|
| MNX_ID | MNXM361232 |
 |
| reference | slm:000124011 |
| formula | C44H74O5 |
| global charge | 0 |
| mol weight | 683.071 |
| InChIKey | IZXRTOACJVPDGG-ZXIMFHGZSA-N |
| InChI | InChI=1S/C44H74O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-39-44(47)49-42(40-45)41-48-43(46)38-36-34-32-30-28-26-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,29,31,42,45H,3-4,6,8-10,12,14-16,18,20,23,26-28,30,32-41H2,1-2H3/b7-5-,13-11-,19-17-,22-21-,25-24-,31-29-/t42-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C44H74O5/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-39-44(47)49-42(40-45)41-48-43(46)38-36-34-32-30-28-26-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,29,31,42,45H,3-4,6,8-10,12,14-16,18,20,23,26-28,30,32-41H2,1-2H3/b7-5-,13-11-,19-17-,22-21-,25-24-,31-29-/t42-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:35][CH2:37][CH2:39][C:44](=[O:47])[O:49][C@@H:42]([CH2:40][OH:45])[CH2:41][O:48][C:43]([CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:46] |
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