| Properties | Image |
|---|
| MNX_ID | MNXM1170172 |
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| reference | envipathM:...5f2f6aab05ed |
| formula | C54H94O12 |
| global charge | 0 |
| mol weight | 935.334 |
| InChIKey | YDOOVESLNVKPBR-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O12/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-31-39-53(60)64-44(42-62-52(59)38-30-22-17-20-29-37-49-51(66-49)41-50-48(65-50)36-6-4-2)43-63-54(61)47(58)35-28-24-23-27-34-46(57)45(56)33-26-19-18-25-32-40-55/h8-9,19,26,44-45,47-51,55-56,58H,3-7,10-18,20-25,27-43H2,1-2H3 |
| SMILES | CCCCC=CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(O)CCCCCCC(=O)C(O)CC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H94O12/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-31-39-53(60)64-44(42-62-52(59)38-30-22-17-20-29-37-49-51(66-49)41-50-48(65-50)36-6-4-2)43-63-54(61)47(58)35-28-24-23-27-34-46(57)45(56)33-26-19-18-25-32-40-55/h8-9,19,26,44-45,47-51,55-56,58H,3-7,10-18,20-25,27-43H2,1-2H3/b9-8?,26-19?/t44?,45?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:21][CH2:31][CH2:39][C:53](=[O:60])[O:64][CH:44]([CH2:42][O:62][C:52]([CH2:38][CH2:30][CH2:22][CH2:17][CH2:20][CH2:29][CH2:37][CH:49]1[CH:51]([CH2:41][CH:50]2[CH:48]([CH2:36][CH2:6][CH2:4][CH3:2])[O:65]2)[O:66]1)=[O:59])[CH2:43][O:63][C:54]([CH:47]([CH2:35][CH2:28][CH2:24][CH2:23][CH2:27][CH2:34][C:46]([CH:45]([CH2:33][CH:26]=[CH:19][CH2:18][CH2:25][CH2:32][CH2:40][OH:55])[OH:56])=[O:57])[OH:58])=[O:61] |
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