| Properties | Image |
|---|
| MNX_ID | MNXM338491 |
 |
| reference | slm:000138410 |
| formula | C52H88O6 |
| global charge | 0 |
| mol weight | 809.27 |
| InChIKey | NAWILHROQHBILH-BGVQLCCHSA-N |
| InChI | InChI=1S/C52H88O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-31-34-36-39-42-45-51(54)57-48-49(58-52(55)46-43-40-37-32-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-33-30-20-17-14-11-8-5-2/h14,16-17,19,23-24,26-27,29,31,36,39,49H,4-13,15,18,20-22,25,28,30,32-35,37-38,40-48H2,1-3H3/b17-14-,19-16-,24-23-,27-26-,31-29-,39-36-/t49-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H88O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-31-34-36-39-42-45-51(54)57-48-49(58-52(55)46-43-40-37-32-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-33-30-20-17-14-11-8-5-2/h14,16-17,19,23-24,26-27,29,31,36,39,49H,4-13,15,18,20-22,25,28,30,32-35,37-38,40-48H2,1-3H3/b17-14-,19-16-,24-23-,27-26-,31-29-,39-36-/t49-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:31]\[CH2:34]/[CH:36]=[CH: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][CH2:33][CH2:30][CH2:20]/[CH:17]=[CH:14]\[CH2:11][CH2:8][CH2:5][CH3:2])=[O:53])[O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:32][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:55] |
|