| Properties | Image |
|---|
| MNX_ID | MNXM1179711 |
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| reference | envipathM:...50fc01dc6b53 |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | RYJGVPKVSPZPSC-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-4-7-10-12-13-17-24-32-44(55)33-25-22-23-31-40-54(60)63-45(42-61-52(58)38-29-20-14-18-27-35-47(57)46(56)34-26-16-11-8-5-2)43-62-53(59)39-30-21-15-19-28-37-49-51(65-49)41-50-48(64-50)36-9-6-3/h12-13,24,32,45-46,48-51,56H,4-11,14-23,25-31,33-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CC(=O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC(=O)C(O)CCCCCCC)COC(=O)CCCCCCCC1OC1CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-4-7-10-12-13-17-24-32-44(55)33-25-22-23-31-40-54(60)63-45(42-61-52(58)38-29-20-14-18-27-35-47(57)46(56)34-26-16-11-8-5-2)43-62-53(59)39-30-21-15-19-28-37-49-51(65-49)41-50-48(64-50)36-9-6-3/h12-13,24,32,45-46,48-51,56H,4-11,14-23,25-31,33-43H2,1-3H3/b13-12?,32-24?/t45?,46?,48?,49?,50?,51? |
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| 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][CH2:27][CH2:35][C:47]([CH:46]([CH2:34][CH2:26][CH2:16][CH2:11][CH2:8][CH2:5][CH3:2])[OH:56])=[O:57])=[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:51]([CH2:41][CH:50]2[CH:48]([CH2:36][CH2:9][CH2:6][CH3:3])[O:64]2)[O:65]1)=[O:59])=[O:55] |
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