| Properties | Image |
|---|
| MNX_ID | MNXM1171575 |
 |
| reference | envipathM:...eaf1a672813b |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | FJTQUCMGMZQQLE-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-25-33-40-53(60)63-44(43-62-52(59)39-32-27-22-24-30-37-49-54(65-49)46(56)35-28-11-8-5-2)42-61-51(58)38-31-26-21-23-29-36-48-50(64-48)41-47(57)45(55)34-9-6-3/h12-13,15-16,28,35,44-46,48-50,54-56H,4-11,14,17-27,29-34,36-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC(=O)C(O)CCCC)COC(=O)CCCCCCCC1OC1C(O)C=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-25-33-40-53(60)63-44(43-62-52(59)39-32-27-22-24-30-37-49-54(65-49)46(56)35-28-11-8-5-2)42-61-51(58)38-31-26-21-23-29-36-48-50(64-48)41-47(57)45(55)34-9-6-3/h12-13,15-16,28,35,44-46,48-50,54-56H,4-11,14,17-27,29-34,36-43H2,1-3H3/b13-12?,16-15?,35-28?/t44?,45?,46?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:12]=[CH:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:25][CH2:33][CH2:40][C:53](=[O:60])[O:63][CH:44]([CH2:42][O:61][C:51]([CH2:38][CH2:31][CH2:26][CH2:21][CH2:23][CH2:29][CH2:36][CH:48]1[CH:50]([CH2:41][C:47]([CH:45]([CH2:34][CH2:9][CH2:6][CH3:3])[OH:55])=[O:57])[O:64]1)=[O:58])[CH2:43][O:62][C:52]([CH2:39][CH2:32][CH2:27][CH2:22][CH2:24][CH2:30][CH2:37][CH:49]1[CH:54]([CH:46]([CH:35]=[CH:28][CH2:11][CH2:8][CH2:5][CH3:2])[OH:56])[O:65]1)=[O:59] |
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