| Properties | Image |
|---|
| MNX_ID | MNXM337511 |
 |
| reference | slm:000126726 |
| formula | C46H82O6 |
| global charge | 0 |
| mol weight | 731.156 |
| InChIKey | LNBFALNUMSBSJZ-UCFQLFQFSA-N |
| InChI | InChI=1S/C46H82O6/c1-5-7-9-11-13-15-17-18-20-22-26-31-35-39-46(49)52-43(41-51-45(48)38-34-30-27-23-24-28-32-36-42(3)4)40-50-44(47)37-33-29-25-21-19-16-14-12-10-8-6-2/h9,11-12,14-15,17,42-43H,5-8,10,13,16,18-41H2,1-4H3/b11-9-,14-12-,17-15-/t43-/m1/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C46H82O6/c1-5-7-9-11-13-15-17-18-20-22-26-31-35-39-46(49)52-43(41-51-45(48)38-34-30-27-23-24-28-32-36-42(3)4)40-50-44(47)37-33-29-25-21-19-16-14-12-10-8-6-2/h9,11-12,14-15,17,42-43H,5-8,10,13,16,18-41H2,1-4H3/b11-9-,14-12-,17-15-/t43-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7]/[CH:9]=[CH:11]\[CH2:13]/[CH:15]=[CH:17]\[CH2:18][CH2:20][CH2:22][CH2:26][CH2:31][CH2:35][CH2:39][C:46](=[O:49])[O:52][C@H:43]([CH2:40][O:50][C:44]([CH2:37][CH2:33][CH2:29][CH2:25][CH2:21][CH2:19][CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH3:2])=[O:47])[CH2:41][O:51][C:45]([CH2:38][CH2:34][CH2:30][CH2:27][CH2:23][CH2:24][CH2:28][CH2:32][CH2:36][CH:42]([CH3:3])[CH3:4])=[O:48] |
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