| Properties | Image |
|---|
| MNX_ID | MNXM1190633 |
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| reference | envipathM:...f4f6c0fc79ca |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | ADQIDGPJRHOUGI-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-3-5-6-15-23-33-46-47(63-46)34-24-17-13-20-26-37-52(57)60-42-45(62-54(59)39-28-19-12-10-8-7-9-11-16-22-32-44(56)31-4-2)43-61-53(58)38-27-21-14-18-25-35-48-50(64-48)41-51-49(65-51)36-29-30-40-55/h15,22-23,32,44-51,55-56H,3-14,16-21,24-31,33-43H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCCO)OC(=O)CCCCCCCCCCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-3-5-6-15-23-33-46-47(63-46)34-24-17-13-20-26-37-52(57)60-42-45(62-54(59)39-28-19-12-10-8-7-9-11-16-22-32-44(56)31-4-2)43-61-53(58)38-27-21-14-18-25-35-48-50(64-48)41-51-49(65-51)36-29-30-40-55/h15,22-23,32,44-51,55-56H,3-14,16-21,24-31,33-43H2,1-2H3/b23-15?,32-22?/t44?,45?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:15]=[CH:23][CH2:33][CH:46]1[CH:47]([CH2:34][CH2:24][CH2:17][CH2:13][CH2:20][CH2:26][CH2:37][C:52](=[O:57])[O:60][CH2:42][CH:45]([CH2:43][O:61][C:53]([CH2:38][CH2:27][CH2:21][CH2:14][CH2:18][CH2:25][CH2:35][CH:48]2[CH:50]([CH2:41][CH:51]3[CH:49]([CH2:36][CH2:29][CH2:30][CH2:40][OH:55])[O:65]3)[O:64]2)=[O:58])[O:62][C:54]([CH2:39][CH2:28][CH2:19][CH2:12][CH2:10][CH2:8][CH2:7][CH2:9][CH2:11][CH2:16][CH:22]=[CH:32][CH:44]([CH2:31][CH2:4][CH3:2])[OH:56])=[O:59])[O:63]1 |
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