| Properties | Image |
|---|
| MNX_ID | MNXM1183531 |
 |
| reference | envipathM:...1f77ea0f01e9 |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | CWJIJHJBWBTNLA-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-4-7-9-25-33-45(56)54-48(65-54)36-27-20-17-23-29-38-52(58)61-42-44(62-53(59)39-30-21-15-13-11-10-12-14-18-24-32-43(55)31-6-3)41-60-51(57)37-28-22-16-19-26-35-47-50(64-47)40-49-46(63-49)34-8-5-2/h24,32,43-44,46-50,54-55H,4-23,25-31,33-42H2,1-3H3 |
| SMILES | CCCCCCC(=O)C1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCCCCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-4-7-9-25-33-45(56)54-48(65-54)36-27-20-17-23-29-38-52(58)61-42-44(62-53(59)39-30-21-15-13-11-10-12-14-18-24-32-43(55)31-6-3)41-60-51(57)37-28-22-16-19-26-35-47-50(64-47)40-49-46(63-49)34-8-5-2/h24,32,43-44,46-50,54-55H,4-23,25-31,33-42H2,1-3H3/b32-24?/t43?,44?,46?,47?,48?,49?,50?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:25][CH2:33][C:45]([CH:54]1[CH:48]([CH2:36][CH2:27][CH2:20][CH2:17][CH2:23][CH2:29][CH2:38][C:52](=[O:58])[O:61][CH2:42][CH:44]([CH2:41][O:60][C:51]([CH2:37][CH2:28][CH2:22][CH2:16][CH2:19][CH2:26][CH2:35][CH:47]2[CH:50]([CH2:40][CH:49]3[CH:46]([CH2:34][CH2:8][CH2:5][CH3:2])[O:63]3)[O:64]2)=[O:57])[O:62][C:53]([CH2:39][CH2:30][CH2:21][CH2:15][CH2:13][CH2:11][CH2:10][CH2:12][CH2:14][CH2:18][CH:24]=[CH:32][CH:43]([CH2:31][CH2:6][CH3:3])[OH:55])=[O:59])[O:65]1)=[O:56] |
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