| Properties | Image |
|---|
| MNX_ID | MNXM230125 |
 |
| reference | slm:000133293 |
| formula | C50H90O6 |
| global charge | 0 |
| mol weight | 787.264 |
| InChIKey | GYMVLWKWYGWNOQ-IKRANHAQSA-N |
| InChI | InChI=1S/C50H90O6/c1-5-7-9-11-13-15-16-17-18-19-22-26-29-33-37-41-48(51)54-44-47(56-50(53)43-39-35-31-24-14-12-10-8-6-2)45-55-49(52)42-38-34-30-27-23-20-21-25-28-32-36-40-46(3)4/h7,9,13,15,17-18,46-47H,5-6,8,10-12,14,16,19-45H2,1-4H3/b9-7-,15-13-,18-17-/t47-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H90O6/c1-5-7-9-11-13-15-16-17-18-19-22-26-29-33-37-41-48(51)54-44-47(56-50(53)43-39-35-31-24-14-12-10-8-6-2)45-55-49(52)42-38-34-30-27-23-20-21-25-28-32-36-40-46(3)4/h7,9,13,15,17-18,46-47H,5-6,8,10-12,14,16,19-45H2,1-4H3/b9-7-,15-13-,18-17-/t47-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:22][CH2:26][CH2:29][CH2:33][CH2:37][CH2:41][C:48](=[O:51])[O:54][CH2:44][C@@H:47]([CH2:45][O:55][C:49]([CH2:42][CH2:38][CH2:34][CH2:30][CH2:27][CH2:23][CH2:20][CH2:21][CH2:25][CH2:28][CH2:32][CH2:36][CH2:40][CH:46]([CH3:3])[CH3:4])=[O:52])[O:56][C:50]([CH2:43][CH2:39][CH2:35][CH2:31][CH2:24][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:53] |
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