| Properties | Image |
|---|
| MNX_ID | MNXM357899 |
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| reference | slm:000141455 |
| formula | C52H98O6 |
| global charge | 0 |
| mol weight | 819.35 |
| InChIKey | JWZZVIXVSPTGSQ-PFCQIXKXSA-N |
| InChI | InChI=1S/C52H98O6/c1-4-7-10-13-16-19-21-23-24-25-26-27-29-30-33-36-39-42-45-51(54)57-48-49(47-56-50(53)44-41-38-35-32-18-15-12-9-6-3)58-52(55)46-43-40-37-34-31-28-22-20-17-14-11-8-5-2/h31,34,49H,4-30,32-33,35-48H2,1-3H3/b34-31-/t49-/m0/s1 |
| SMILES | CCCCCCCCC/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H98O6/c1-4-7-10-13-16-19-21-23-24-25-26-27-29-30-33-36-39-42-45-51(54)57-48-49(47-56-50(53)44-41-38-35-32-18-15-12-9-6-3)58-52(55)46-43-40-37-34-31-28-22-20-17-14-11-8-5-2/h31,34,49H,4-30,32-33,35-48H2,1-3H3/b34-31-/t49-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:29][CH2:30][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][C:51](=[O:54])[O:57][CH2:48][C@H:49]([CH2:47][O:56][C:50]([CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:53])[O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37]/[CH:34]=[CH:31]\[CH2:28][CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55] |
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