| Properties | Image |
|---|
| MNX_ID | MNXM1193984 |
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| reference | envipathM:...5eb792bde73d |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | VTZOUHQMERXSJQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-4-7-9-18-26-35-48-49(64-48)36-27-20-16-23-29-38-52(58)61-42-45(63-54(60)40-31-22-15-13-11-10-12-14-19-25-33-44(55)32-6-3)43-62-53(59)39-30-24-17-21-28-37-50-51(65-50)41-47(57)46(56)34-8-5-2/h12,14,18,26,45-51,56-57H,4-11,13,15-17,19-25,27-43H2,1-3H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC(O)C(O)CCCC)OC(=O)CCCCCCCC=CCCCC(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-4-7-9-18-26-35-48-49(64-48)36-27-20-16-23-29-38-52(58)61-42-45(63-54(60)40-31-22-15-13-11-10-12-14-19-25-33-44(55)32-6-3)43-62-53(59)39-30-24-17-21-28-37-50-51(65-50)41-47(57)46(56)34-8-5-2/h12,14,18,26,45-51,56-57H,4-11,13,15-17,19-25,27-43H2,1-3H3/b14-12?,26-18?/t45?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:18]=[CH:26][CH2:35][CH:48]1[CH:49]([CH2:36][CH2:27][CH2:20][CH2:16][CH2:23][CH2:29][CH2:38][C:52](=[O:58])[O:61][CH2:42][CH:45]([CH2:43][O:62][C:53]([CH2:39][CH2:30][CH2:24][CH2:17][CH2:21][CH2:28][CH2:37][CH:50]2[CH:51]([CH2:41][CH:47]([CH:46]([CH2:34][CH2:8][CH2:5][CH3:2])[OH:56])[OH:57])[O:65]2)=[O:59])[O:63][C:54]([CH2:40][CH2:31][CH2:22][CH2:15][CH2:13][CH2:11][CH2:10][CH:12]=[CH:14][CH2:19][CH2:25][CH2:33][C:44]([CH2:32][CH2:6][CH3:3])=[O:55])=[O:60])[O:64]1 |
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