| Properties | Image |
|---|
| MNX_ID | MNXM1192526 |
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| reference | envipathM:...fbc858533be3 |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | GPPAUQLKZADYOZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-3-5-7-16-24-34-46-47(63-46)35-25-18-14-21-27-37-52(57)60-42-45(62-54(59)39-29-20-13-11-9-8-10-12-17-23-31-44(56)32-30-40-55)43-61-53(58)38-28-22-15-19-26-36-49-51(65-49)41-50-48(64-50)33-6-4-2/h10,12,16,23-24,31,44-51,55-56H,3-9,11,13-15,17-22,25-30,32-43H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCC=CCC=CC(O)CCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-3-5-7-16-24-34-46-47(63-46)35-25-18-14-21-27-37-52(57)60-42-45(62-54(59)39-29-20-13-11-9-8-10-12-17-23-31-44(56)32-30-40-55)43-61-53(58)38-28-22-15-19-26-36-49-51(65-49)41-50-48(64-50)33-6-4-2/h10,12,16,23-24,31,44-51,55-56H,3-9,11,13-15,17-22,25-30,32-43H2,1-2H3/b12-10?,24-16?,31-23?/t44?,45?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:16]=[CH:24][CH2:34][CH:46]1[CH:47]([CH2:35][CH2:25][CH2:18][CH2:14][CH2:21][CH2:27][CH2:37][C:52](=[O:57])[O:60][CH2:42][CH:45]([CH2:43][O:61][C:53]([CH2:38][CH2:28][CH2:22][CH2:15][CH2:19][CH2:26][CH2:36][CH:49]2[CH:51]([CH2:41][CH:50]3[CH:48]([CH2:33][CH2:6][CH2:4][CH3:2])[O:64]3)[O:65]2)=[O:58])[O:62][C:54]([CH2:39][CH2:29][CH2:20][CH2:13][CH2:11][CH2:9][CH2:8][CH:10]=[CH:12][CH2:17][CH:23]=[CH:31][CH:44]([CH2:32][CH2:30][CH2:40][OH:55])[OH:56])=[O:59])[O:63]1 |
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