| Properties | Image |
|---|
| MNX_ID | MNXM1185002 |
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| reference | envipathM:...040d5876f6bd |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | HDEOGQURYUEAOQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-31-39-53(59)62-44(42-60-51(57)37-29-22-17-19-27-35-46-47(63-46)36-28-20-18-25-32-40-55)43-61-52(58)38-30-24-23-26-33-45(56)54-50(65-54)41-49-48(64-49)34-6-4-2/h20,28,40,44-50,54,56H,3-19,21-27,29-39,41-43H2,1-2H3 |
| SMILES | CCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC=CCCCC=O)COC(=O)CCCCCCC(O)C1OC1CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-31-39-53(59)62-44(42-60-51(57)37-29-22-17-19-27-35-46-47(63-46)36-28-20-18-25-32-40-55)43-61-52(58)38-30-24-23-26-33-45(56)54-50(65-54)41-49-48(64-49)34-6-4-2/h20,28,40,44-50,54,56H,3-19,21-27,29-39,41-43H2,1-2H3/b28-20?/t44?,45?,46?,47?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:21][CH2:31][CH2:39][C:53](=[O:59])[O:62][CH:44]([CH2:42][O:60][C:51]([CH2:37][CH2:29][CH2:22][CH2:17][CH2:19][CH2:27][CH2:35][CH:46]1[CH:47]([CH2:36][CH:28]=[CH:20][CH2:18][CH2:25][CH2:32][CH:40]=[O:55])[O:63]1)=[O:57])[CH2:43][O:61][C:52]([CH2:38][CH2:30][CH2:24][CH2:23][CH2:26][CH2:33][CH:45]([CH:54]1[CH:50]([CH2:41][CH:49]2[CH:48]([CH2:34][CH2:6][CH2:4][CH3:2])[O:64]2)[O:65]1)[OH:56])=[O:58] |
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