| Properties | Image |
|---|
| MNX_ID | MNXM1172124 |
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| reference | envipathM:...c34733e86589 |
| formula | C54H96O11 |
| global charge | 0 |
| mol weight | 921.351 |
| InChIKey | DIGTUJYVFQERFA-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O11/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(59)63-44(42-61-51(57)38-31-26-20-23-29-36-48-47(64-48)35-28-22-10-8-5-2)43-62-52(58)39-32-27-21-24-30-37-49-50(65-49)41-46(56)54(60)45(55)34-6-3/h22,28,44,46-50,54,56,60H,4-21,23-27,29-43H2,1-3H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC(O)C(O)C(=O)CCC)OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H96O11/c1-4-7-9-11-12-13-14-15-16-17-18-19-25-33-40-53(59)63-44(42-61-51(57)38-31-26-20-23-29-36-48-47(64-48)35-28-22-10-8-5-2)43-62-52(58)39-32-27-21-24-30-37-49-50(65-49)41-46(56)54(60)45(55)34-6-3/h22,28,44,46-50,54,56,60H,4-21,23-27,29-43H2,1-3H3/b28-22?/t44?,46?,47?,48?,49?,50?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:25][CH2:33][CH2:40][C:53](=[O:59])[O:63][CH:44]([CH2:42][O:61][C:51]([CH2:38][CH2:31][CH2:26][CH2:20][CH2:23][CH2:29][CH2:36][CH:48]1[CH:47]([CH2:35][CH:28]=[CH:22][CH2:10][CH2:8][CH2:5][CH3:2])[O:64]1)=[O:57])[CH2:43][O:62][C:52]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:30][CH2:37][CH:49]1[CH:50]([CH2:41][CH:46]([CH:54]([C:45]([CH2:34][CH2:6][CH3:3])=[O:55])[OH:60])[OH:56])[O:65]1)=[O:58] |
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