| Properties | Image |
|---|
| MNX_ID | MNXM1182208 |
 |
| reference | envipathM:...6043033f7623 |
| formula | C54H94O12 |
| global charge | 0 |
| mol weight | 935.334 |
| InChIKey | YVEWFFTYQRMPKK-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O12/c1-3-5-6-18-26-34-46-47(64-46)35-27-20-16-22-29-37-51(58)61-41-43(63-54(60)45(57)33-25-19-14-12-10-8-7-9-11-13-15-24-31-39-55)42-62-52(59)38-30-23-17-21-28-36-48-49(65-48)40-50-53(66-50)44(56)32-4-2/h7-8,11,13,43-50,53,55-57H,3-6,9-10,12,14-42H2,1-2H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1C(O)CCC)OC(=O)C(O)CCCCCCC=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H94O12/c1-3-5-6-18-26-34-46-47(64-46)35-27-20-16-22-29-37-51(58)61-41-43(63-54(60)45(57)33-25-19-14-12-10-8-7-9-11-13-15-24-31-39-55)42-62-52(59)38-30-23-17-21-28-36-48-49(65-48)40-50-53(66-50)44(56)32-4-2/h7-8,11,13,43-50,53,55-57H,3-6,9-10,12,14-42H2,1-2H3/b8-7?,13-11?/t43?,44?,45?,46?,47?,48?,49?,50?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:18][CH2:26][CH2:34][CH:46]1[CH:47]([CH2:35][CH2:27][CH2:20][CH2:16][CH2:22][CH2:29][CH2:37][C:51](=[O:58])[O:61][CH2:41][CH:43]([CH2:42][O:62][C:52]([CH2:38][CH2:30][CH2:23][CH2:17][CH2:21][CH2:28][CH2:36][CH:48]2[CH:49]([CH2:40][CH:50]3[CH:53]([CH:44]([CH2:32][CH2:4][CH3:2])[OH:56])[O:66]3)[O:65]2)=[O:59])[O:63][C:54]([CH:45]([CH2:33][CH2:25][CH2:19][CH2:14][CH2:12][CH2:10][CH:8]=[CH:7][CH2:9][CH:11]=[CH:13][CH2:15][CH2:24][CH2:31][CH2:39][OH:55])[OH:57])=[O:60])[O:64]1 |
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