| Properties | Image |
|---|
| MNX_ID | MNXM1189072 |
 |
| reference | envipathM:...bd72c209adda |
| formula | C54H96O12 |
| global charge | 0 |
| mol weight | 937.35 |
| InChIKey | WJWNSUZMZUDJPJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O12/c1-4-7-10-11-12-13-14-15-16-17-18-21-28-34-46(57)54(61)64-44(41-62-52(59)37-30-24-19-22-27-33-45(56)47(58)39-43(55)32-26-8-5-2)42-63-53(60)38-31-25-20-23-29-36-49-51(66-49)40-50-48(65-50)35-9-6-3/h14-15,43-46,48-51,55-57H,4-13,16-42H2,1-3H3 |
| SMILES | CCCCCCCC=CCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC(O)C(=O)CC(O)CCCCC)COC(=O)CCCCCCCC1OC1CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H96O12/c1-4-7-10-11-12-13-14-15-16-17-18-21-28-34-46(57)54(61)64-44(41-62-52(59)37-30-24-19-22-27-33-45(56)47(58)39-43(55)32-26-8-5-2)42-63-53(60)38-31-25-20-23-29-36-49-51(66-49)40-50-48(65-50)35-9-6-3/h14-15,43-46,48-51,55-57H,4-13,16-42H2,1-3H3/b15-14?/t43?,44?,45?,46?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:11][CH2:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:21][CH2:28][CH2:34][CH:46]([C:54](=[O:61])[O:64][CH:44]([CH2:41][O:62][C:52]([CH2:37][CH2:30][CH2:24][CH2:19][CH2:22][CH2:27][CH2:33][CH:45]([C:47]([CH2:39][CH:43]([CH2:32][CH2:26][CH2:8][CH2:5][CH3:2])[OH:55])=[O:58])[OH:56])=[O:59])[CH2:42][O:63][C:53]([CH2:38][CH2:31][CH2:25][CH2:20][CH2:23][CH2:29][CH2:36][CH:49]1[CH:51]([CH2:40][CH:50]2[CH:48]([CH2:35][CH2:9][CH2:6][CH3:3])[O:65]2)[O:66]1)=[O:60])[OH:57] |
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