| Properties | Image |
|---|
| MNX_ID | MNXM1182701 |
 |
| reference | envipathM:...9212948026d1 |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | IDHQOQCFZGMVRI-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-3-5-7-8-9-10-11-12-13-14-15-18-25-33-45(57)54(60)63-43(41-61-52(58)38-30-21-16-19-27-35-46-47(64-46)36-28-20-17-24-31-39-55)42-62-53(59)44(56)32-26-22-23-29-37-49-51(66-49)40-50-48(65-50)34-6-4-2/h8-9,20,28,39,43-51,56-57H,3-7,10-19,21-27,29-38,40-42H2,1-2H3 |
| SMILES | CCCCC=CCCCCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC1OC1CC=CCCCC=O)COC(=O)C(O)CCCCCCC1OC1CC1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-3-5-7-8-9-10-11-12-13-14-15-18-25-33-45(57)54(60)63-43(41-61-52(58)38-30-21-16-19-27-35-46-47(64-46)36-28-20-17-24-31-39-55)42-62-53(59)44(56)32-26-22-23-29-37-49-51(66-49)40-50-48(65-50)34-6-4-2/h8-9,20,28,39,43-51,56-57H,3-7,10-19,21-27,29-38,40-42H2,1-2H3/b9-8?,28-20?/t43?,44?,45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:18][CH2:25][CH2:33][CH:45]([C:54](=[O:60])[O:63][CH:43]([CH2:41][O:61][C:52]([CH2:38][CH2:30][CH2:21][CH2:16][CH2:19][CH2:27][CH2:35][CH:46]1[CH:47]([CH2:36][CH:28]=[CH:20][CH2:17][CH2:24][CH2:31][CH:39]=[O:55])[O:64]1)=[O:58])[CH2:42][O:62][C:53]([CH:44]([CH2:32][CH2:26][CH2:22][CH2:23][CH2:29][CH2:37][CH:49]1[CH:51]([CH2:40][CH:50]2[CH:48]([CH2:34][CH2:6][CH2:4][CH3:2])[O:65]2)[O:66]1)[OH:56])=[O:59])[OH:57] |
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