| Properties | Image |
|---|
| MNX_ID | MNXM336615 |
 |
| reference | slm:000142046 |
| formula | C53H88O6 |
| global charge | 0 |
| mol weight | 821.281 |
| InChIKey | HILJHHOWKQMBGA-NGMMCPGXSA-N |
| InChI | InChI=1S/C53H88O6/c1-4-7-10-13-16-19-22-24-25-26-27-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-28-23-20-17-14-11-8-5-2/h7,10,15-16,18-20,23-25,27,29,35,38,50H,4-6,8-9,11-14,17,21-22,26,28,30-34,36-37,39-49H2,1-3H3/b10-7-,18-15-,19-16-,23-20-,25-24-,29-27-,38-35-/t50-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H88O6/c1-4-7-10-13-16-19-22-24-25-26-27-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-28-23-20-17-14-11-8-5-2/h7,10,15-16,18-20,23-25,27,29,35,38,50H,4-6,8-9,11-14,17,21-22,26,28,30-34,36-37,39-49H2,1-3H3/b10-7-,18-15-,19-16-,23-20-,25-24-,29-27-,38-35-/t50-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:29]\[CH2:32]/[CH:35]=[CH:38]\[CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][C@H:50]([CH2:48][O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:54])[CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:28]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55] |
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