| Properties | Image |
|---|
| MNX_ID | MNXM49994 |
 |
| reference | slm:000125712 |
| formula | C46H82O5 |
| global charge | 0 |
| mol weight | 715.157 |
| InChIKey | DHKKTSJTVZCIKC-OIGUOTQVSA-N |
| InChI | InChI=1S/C46H82O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(49)51-44(42-47)43-50-45(48)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,29,31,44,47H,3-10,12,14-16,18,20-22,24,26-28,30,32-43H2,1-2H3/b13-11-,19-17-,25-23-,31-29-/t44-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C46H82O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(49)51-44(42-47)43-50-45(48)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,29,31,44,47H,3-10,12,14-16,18,20-22,24,26-28,30,32-43H2,1-2H3/b13-11-,19-17-,25-23-,31-29-/t44-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:46](=[O:49])[O:51][C@@H:44]([CH2:42][OH:47])[CH2:43][O:50][C:45]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:48] |
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