| Properties | Image |
|---|
| MNX_ID | MNXM1196967 |
 |
| reference | envipathM:...edf76ead6af7 |
| formula | C54H91O11 |
| global charge | -1 |
| mol weight | 916.311 |
| InChIKey | QLHFEZGQFBZLAT-UHFFFAOYSA-M |
| InChI | InChI=1S/C54H92O11/c1-3-5-7-9-10-11-12-13-14-15-16-17-23-31-40-54(59)62-44(42-60-52(57)38-29-24-18-21-27-34-46-45(63-46)33-26-20-8-6-4-2)43-61-53(58)39-30-25-19-22-28-35-47-49(64-47)41-50-48(65-50)36-32-37-51(55)56/h12-13,20,26,44-50H,3-11,14-19,21-25,27-43H2,1-2H3,(H,55,56)/p-1 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC(=O)[O-])OC(=O)CCCCCCCC=CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-3-5-7-9-10-11-12-13-14-15-16-17-23-31-40-54(59)62-44(42-60-52(57)38-29-24-18-21-27-34-46-45(63-46)33-26-20-8-6-4-2)43-61-53(58)39-30-25-19-22-28-35-47-49(64-47)41-50-48(65-50)36-32-37-51(55)56/h12-13,20,26,44-50H,3-11,14-19,21-25,27-43H2,1-2H3,(H,55,56)/b13-12?,26-20?/t44?,45?,46?,47?,48?,49?,50? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:10][CH2:11][CH:12]=[CH:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:23][CH2:31][CH2:40][C:54](=[O:59])[O:62][CH:44]([CH2:42][O:60][C:52]([CH2:38][CH2:29][CH2:24][CH2:18][CH2:21][CH2:27][CH2:34][CH:46]1[CH:45]([CH2:33][CH:26]=[CH:20][CH2:8][CH2:6][CH2:4][CH3:2])[O:63]1)=[O:57])[CH2:43][O:61][C:53]([CH2:39][CH2:30][CH2:25][CH2:19][CH2:22][CH2:28][CH2:35][CH:47]1[CH:49]([CH2:41][CH:50]2[CH:48]([CH2:36][CH2:32][CH2:37][C:51](=[O:55])[OH:56])[O:65]2)[O:64]1)=[O:58] |
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