| Properties | Image |
|---|
| MNX_ID | MNXM1186334 |
 |
| reference | envipathM:...792f3abafea7 |
| formula | C54H92O13 |
| global charge | 0 |
| mol weight | 949.317 |
| InChIKey | QAOVVZXKXCFZSB-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O13/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-28-34-54(61)64-43(41-63-53(60)33-27-23-18-20-25-31-48-51(67-48)39-50-46(66-50)29-6-4-2)40-62-52(59)32-26-22-17-19-24-30-47-49(65-47)38-42(56)37-45(58)44(57)35-36-55/h8-9,11-12,42-44,46-51,55-57H,3-7,10,13-41H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC(O)CC(=O)C(O)CCO)COC(=O)CCCCCCCC1OC1CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O13/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-28-34-54(61)64-43(41-63-53(60)33-27-23-18-20-25-31-48-51(67-48)39-50-46(66-50)29-6-4-2)40-62-52(59)32-26-22-17-19-24-30-47-49(65-47)38-42(56)37-45(58)44(57)35-36-55/h8-9,11-12,42-44,46-51,55-57H,3-7,10,13-41H2,1-2H3/b9-8?,12-11?/t42?,43?,44?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:21][CH2:28][CH2:34][C:54](=[O:61])[O:64][CH:43]([CH2:40][O:62][C:52]([CH2:32][CH2:26][CH2:22][CH2:17][CH2:19][CH2:24][CH2:30][CH:47]1[CH:49]([CH2:38][CH:42]([CH2:37][C:45]([CH:44]([CH2:35][CH2:36][OH:55])[OH:57])=[O:58])[OH:56])[O:65]1)=[O:59])[CH2:41][O:63][C:53]([CH2:33][CH2:27][CH2:23][CH2:18][CH2:20][CH2:25][CH2:31][CH:48]1[CH:51]([CH2:39][CH:50]2[CH:46]([CH2:29][CH2:6][CH2:4][CH3:2])[O:66]2)[O:67]1)=[O:60] |
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