| Properties | Image |
|---|
| MNX_ID | MNXM1178575 |
 |
| reference | envipathM:...f542072aeb7f |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | MBCAGVIIWJBYLQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-3-5-7-19-28-36-48-54(65-48)45(56)33-26-23-24-30-38-52(58)61-43-44(62-53(59)39-31-21-16-14-12-10-8-9-11-13-15-17-25-32-40-55)42-60-51(57)37-29-22-18-20-27-35-47-50(64-47)41-49-46(63-49)34-6-4-2/h13,15,19,28,40,44-50,54,56H,3-12,14,16-18,20-27,29-39,41-43H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1C(O)CCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCCCCC=CCCCC=O |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-3-5-7-19-28-36-48-54(65-48)45(56)33-26-23-24-30-38-52(58)61-43-44(62-53(59)39-31-21-16-14-12-10-8-9-11-13-15-17-25-32-40-55)42-60-51(57)37-29-22-18-20-27-35-47-50(64-47)41-49-46(63-49)34-6-4-2/h13,15,19,28,40,44-50,54,56H,3-12,14,16-18,20-27,29-39,41-43H2,1-2H3/b15-13?,28-19?/t44?,45?,46?,47?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:19]=[CH:28][CH2:36][CH:48]1[CH:54]([CH:45]([CH2:33][CH2:26][CH2:23][CH2:24][CH2:30][CH2:38][C:52](=[O:58])[O:61][CH2:43][CH:44]([CH2:42][O:60][C:51]([CH2:37][CH2:29][CH2:22][CH2:18][CH2:20][CH2:27][CH2:35][CH:47]2[CH:50]([CH2:41][CH:49]3[CH:46]([CH2:34][CH2:6][CH2:4][CH3:2])[O:63]3)[O:64]2)=[O:57])[O:62][C:53]([CH2:39][CH2:31][CH2:21][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:25][CH2:32][CH:40]=[O:55])=[O:59])[OH:56])[O:65]1 |
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