| Properties | Image |
|---|
| MNX_ID | MNXM1184836 |
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| reference | envipathM:...ba9c680273ce |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | GWGFYFDWVXUVID-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(61)65-44(42-63-51(59)38-31-26-20-23-29-36-46(56)45(55)35-28-22-10-8-5-2)43-64-52(60)39-32-27-21-24-30-37-49-50(66-49)41-48(58)54(62)47(57)34-6-3/h11-12,14-15,22,28,44,46-50,56-58H,4-10,13,16-21,23-27,29-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC(O)C(=O)CC=CCCCC)COC(=O)CCCCCCCC1OC1CC(O)C(=O)C(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(61)65-44(42-63-51(59)38-31-26-20-23-29-36-46(56)45(55)35-28-22-10-8-5-2)43-64-52(60)39-32-27-21-24-30-37-49-50(66-49)41-48(58)54(62)47(57)34-6-3/h11-12,14-15,22,28,44,46-50,56-58H,4-10,13,16-21,23-27,29-43H2,1-3H3/b12-11?,15-14?,28-22?/t44?,46?,47?,48?,49?,50? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:25][CH2:33][CH2:40][C:53](=[O:61])[O:65][CH:44]([CH2:42][O:63][C:51]([CH2:38][CH2:31][CH2:26][CH2:20][CH2:23][CH2:29][CH2:36][CH:46]([C:45]([CH2:35][CH:28]=[CH:22][CH2:10][CH2:8][CH2:5][CH3:2])=[O:55])[OH:56])=[O:59])[CH2:43][O:64][C:52]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:30][CH2:37][CH:49]1[CH:50]([CH2:41][CH:48]([C:54]([CH:47]([CH2:34][CH2:6][CH3:3])[OH:57])=[O:62])[OH:58])[O:66]1)=[O:60] |
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