| Properties | Image |
|---|
| MNX_ID | MNXM1178053 |
 |
| reference | envipathM:...caafaa62951e |
| formula | C54H96O11 |
| global charge | 0 |
| mol weight | 921.351 |
| InChIKey | JSLLRVWJACDGKV-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O11/c1-4-7-9-18-26-35-45-46(63-45)36-27-20-16-23-29-38-49(56)60-41-44(62-51(58)40-31-22-15-13-11-10-12-14-19-25-33-43(55)32-6-3)42-61-50(57)39-30-24-17-21-28-37-48-54(65-48)52(59)53-47(64-53)34-8-5-2/h12,14,43-48,52-55,59H,4-11,13,15-42H2,1-3H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1C(O)C1OC1CCCC)OC(=O)CCCCCCCC=CCCCC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H96O11/c1-4-7-9-18-26-35-45-46(63-45)36-27-20-16-23-29-38-49(56)60-41-44(62-51(58)40-31-22-15-13-11-10-12-14-19-25-33-43(55)32-6-3)42-61-50(57)39-30-24-17-21-28-37-48-54(65-48)52(59)53-47(64-53)34-8-5-2/h12,14,43-48,52-55,59H,4-11,13,15-42H2,1-3H3/b14-12?/t43?,44?,45?,46?,47?,48?,52?,53?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:18][CH2:26][CH2:35][CH:45]1[CH:46]([CH2:36][CH2:27][CH2:20][CH2:16][CH2:23][CH2:29][CH2:38][C:49](=[O:56])[O:60][CH2:41][CH:44]([CH2:42][O:61][C:50]([CH2:39][CH2:30][CH2:24][CH2:17][CH2:21][CH2:28][CH2:37][CH:48]2[CH:54]([CH:52]([CH:53]3[CH:47]([CH2:34][CH2:8][CH2:5][CH3:2])[O:64]3)[OH:59])[O:65]2)=[O:57])[O:62][C:51]([CH2:40][CH2:31][CH2:22][CH2:15][CH2:13][CH2:11][CH2:10][CH:12]=[CH:14][CH2:19][CH2:25][CH2:33][CH:43]([CH2:32][CH2:6][CH3:3])[OH:55])=[O:58])[O:63]1 |
|