| Properties | Image |
|---|
| MNX_ID | MNXM1180393 |
 |
| reference | envipathM:...868b1c183187 |
| formula | C54H94O12 |
| global charge | 0 |
| mol weight | 935.334 |
| InChIKey | JKXZEZPPCYJTSF-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O12/c1-4-7-10-11-12-13-14-15-16-17-18-19-24-32-39-54(62)65-45(42-63-52(60)37-30-25-20-22-28-35-47(57)48(58)40-44(55)33-27-8-5-2)43-64-53(61)38-31-26-21-23-29-36-50-51(66-50)41-49(59)46(56)34-9-6-3/h11-12,14-15,44-47,50-51,55-57H,4-10,13,16-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC(O)C(=O)CC(O)CCCCC)COC(=O)CCCCCCCC1OC1CC(=O)C(O)CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O12/c1-4-7-10-11-12-13-14-15-16-17-18-19-24-32-39-54(62)65-45(42-63-52(60)37-30-25-20-22-28-35-47(57)48(58)40-44(55)33-27-8-5-2)43-64-53(61)38-31-26-21-23-29-36-50-51(66-50)41-49(59)46(56)34-9-6-3/h11-12,14-15,44-47,50-51,55-57H,4-10,13,16-43H2,1-3H3/b12-11?,15-14?/t44?,45?,46?,47?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:24][CH2:32][CH2:39][C:54](=[O:62])[O:65][CH:45]([CH2:42][O:63][C:52]([CH2:37][CH2:30][CH2:25][CH2:20][CH2:22][CH2:28][CH2:35][CH:47]([C:48]([CH2:40][CH:44]([CH2:33][CH2:27][CH2:8][CH2:5][CH3:2])[OH:55])=[O:58])[OH:57])=[O:60])[CH2:43][O:64][C:53]([CH2:38][CH2:31][CH2:26][CH2:21][CH2:23][CH2:29][CH2:36][CH:50]1[CH:51]([CH2:41][C:49]([CH:46]([CH2:34][CH2:9][CH2:6][CH3:3])[OH:56])=[O:59])[O:66]1)=[O:61] |
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