| Properties | Image |
|---|
| MNX_ID | MNXM1190730 |
 |
| reference | envipathM:...c9affc1481df |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | QXYDJQUAHWHRFK-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-3-5-6-7-8-9-10-11-12-13-14-15-22-31-39-53(59)62-44(42-60-51(57)37-29-23-16-19-26-34-46-47(63-46)35-27-21-18-25-32-40-55)43-61-52(58)38-30-24-17-20-28-36-48-49(64-48)41-50-54(65-50)45(56)33-4-2/h7-8,21,27,40,44-50,54,56H,3-6,9-20,22-26,28-39,41-43H2,1-2H3 |
| SMILES | CCCCC=CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC=CCCCC=O)COC(=O)CCCCCCCC1OC1CC1OC1C(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-3-5-6-7-8-9-10-11-12-13-14-15-22-31-39-53(59)62-44(42-60-51(57)37-29-23-16-19-26-34-46-47(63-46)35-27-21-18-25-32-40-55)43-61-52(58)38-30-24-17-20-28-36-48-49(64-48)41-50-54(65-50)45(56)33-4-2/h7-8,21,27,40,44-50,54,56H,3-6,9-20,22-26,28-39,41-43H2,1-2H3/b8-7?,27-21?/t44?,45?,46?,47?,48?,49?,50?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:7]=[CH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:22][CH2:31][CH2:39][C:53](=[O:59])[O:62][CH:44]([CH2:42][O:60][C:51]([CH2:37][CH2:29][CH2:23][CH2:16][CH2:19][CH2:26][CH2:34][CH:46]1[CH:47]([CH2:35][CH:27]=[CH:21][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][CH2:17][CH2:20][CH2:28][CH2:36][CH:48]1[CH:49]([CH2:41][CH:50]2[CH:54]([CH:45]([CH2:33][CH2:4][CH3:2])[OH:56])[O:65]2)[O:64]1)=[O:58] |
|