| Properties | Image |
|---|
| MNX_ID | MNXM1193738 |
 |
| reference | envipathM:...973e556f2f16 |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | SGVBEAIVODCUHB-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-4-7-10-12-13-17-24-32-44(55)33-25-22-23-31-40-54(60)63-45(43-62-53(59)39-30-21-15-19-28-37-49-48(64-49)36-27-16-11-8-5-2)42-61-52(58)38-29-20-14-18-26-34-46(56)47(57)41-51-50(65-51)35-9-6-3/h12-13,24,32,45-51,56-57H,4-11,14-23,25-31,33-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CC(=O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC(O)C(O)CC1OC1CCCC)COC(=O)CCCCCCCC1OC1CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-4-7-10-12-13-17-24-32-44(55)33-25-22-23-31-40-54(60)63-45(43-62-53(59)39-30-21-15-19-28-37-49-48(64-49)36-27-16-11-8-5-2)42-61-52(58)38-29-20-14-18-26-34-46(56)47(57)41-51-50(65-51)35-9-6-3/h12-13,24,32,45-51,56-57H,4-11,14-23,25-31,33-43H2,1-3H3/b13-12?,32-24?/t45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:12]=[CH:13][CH2:17][CH:24]=[CH:32][C:44]([CH2:33][CH2:25][CH2:22][CH2:23][CH2:31][CH2:40][C:54](=[O:60])[O:63][CH:45]([CH2:42][O:61][C:52]([CH2:38][CH2:29][CH2:20][CH2:14][CH2:18][CH2:26][CH2:34][CH:46]([CH:47]([CH2:41][CH:51]1[CH:50]([CH2:35][CH2:9][CH2:6][CH3:3])[O:65]1)[OH:57])[OH:56])=[O:58])[CH2:43][O:62][C:53]([CH2:39][CH2:30][CH2:21][CH2:15][CH2:19][CH2:28][CH2:37][CH:49]1[CH:48]([CH2:36][CH2:27][CH2:16][CH2:11][CH2:8][CH2:5][CH3:2])[O:64]1)=[O:59])=[O:55] |
|