| Properties | Image |
|---|
| MNX_ID | MNXM1187318 |
 |
| reference | envipathM:...934364a8f7b2 |
| formula | C54H90O11 |
| global charge | 0 |
| mol weight | 915.303 |
| InChIKey | MIYBMCBGCYFBQT-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H90O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-24-33-40-53(60)63-44(43-62-52(59)39-32-27-26-28-35-46(56)54-49(65-54)37-30-22-11-8-5-2)42-61-51(58)38-31-25-21-23-29-36-48-50(64-48)41-47(57)45(55)34-9-6-3/h12-13,15-16,22,30,44-45,48-50,54-55H,4-11,14,17-21,23-29,31-43H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC(=O)C(O)CCCC)COC(=O)CCCCCCC(=O)C1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H90O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-24-33-40-53(60)63-44(43-62-52(59)39-32-27-26-28-35-46(56)54-49(65-54)37-30-22-11-8-5-2)42-61-51(58)38-31-25-21-23-29-36-48-50(64-48)41-47(57)45(55)34-9-6-3/h12-13,15-16,22,30,44-45,48-50,54-55H,4-11,14,17-21,23-29,31-43H2,1-3H3/b13-12?,16-15?,30-22?/t44?,45?,48?,49?,50?,54? |
 |
| 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][CH2:24][CH2:33][CH2:40][C:53](=[O:60])[O:63][CH:44]([CH2:42][O:61][C:51]([CH2:38][CH2:31][CH2:25][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][CH2:26][CH2:28][CH2:35][C:46]([CH:54]1[CH:49]([CH2:37][CH:30]=[CH:22][CH2:11][CH2:8][CH2:5][CH3:2])[O:65]1)=[O:56])=[O:59] |
|