| Properties | Image |
|---|
| MNX_ID | MNXM1184740 |
 |
| reference | envipathM:...130221ffc52c |
| formula | C54H94O12 |
| global charge | 0 |
| mol weight | 935.334 |
| InChIKey | DFYFWMHOHFBMAV-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O12/c1-3-5-7-9-10-11-12-13-14-15-16-19-25-33-45(57)54(60)63-43(42-62-52(59)38-29-23-22-24-32-44(56)53-48(66-53)36-27-18-8-6-4-2)41-61-51(58)37-28-21-17-20-26-34-46-49(64-46)40-50-47(65-50)35-30-31-39-55/h9-10,18,27,43-50,53,55-57H,3-8,11-17,19-26,28-42H2,1-2H3 |
| SMILES | CCCCC=CCCCCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCCO)COC(=O)CCCCCCC(O)C1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O12/c1-3-5-7-9-10-11-12-13-14-15-16-19-25-33-45(57)54(60)63-43(42-62-52(59)38-29-23-22-24-32-44(56)53-48(66-53)36-27-18-8-6-4-2)41-61-51(58)37-28-21-17-20-26-34-46-49(64-46)40-50-47(65-50)35-30-31-39-55/h9-10,18,27,43-50,53,55-57H,3-8,11-17,19-26,28-42H2,1-2H3/b10-9?,27-18?/t43?,44?,45?,46?,47?,48?,49?,50?,53? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:25][CH2:33][CH:45]([C:54](=[O:60])[O:63][CH:43]([CH2:41][O:61][C:51]([CH2:37][CH2:28][CH2:21][CH2:17][CH2:20][CH2:26][CH2:34][CH:46]1[CH:49]([CH2:40][CH:50]2[CH:47]([CH2:35][CH2:30][CH2:31][CH2:39][OH:55])[O:65]2)[O:64]1)=[O:58])[CH2:42][O:62][C:52]([CH2:38][CH2:29][CH2:23][CH2:22][CH2:24][CH2:32][CH:44]([CH:53]1[CH:48]([CH2:36][CH:27]=[CH:18][CH2:8][CH2:6][CH2:4][CH3:2])[O:66]1)[OH:56])=[O:59])[OH:57] |
|