| Properties | Image |
|---|
| MNX_ID | MNXM1191599 |
 |
| reference | envipathM:...20916c9a78ae |
| formula | C54H94O13 |
| global charge | 0 |
| mol weight | 951.333 |
| InChIKey | OGELJNYTVDTWMY-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O13/c1-4-7-10-11-12-13-14-15-16-17-18-19-24-31-38-51(60)65-42(40-63-49(58)36-29-25-20-22-27-34-46-48(66-46)39-45(57)43(55)32-8-5-2)41-64-50(59)37-30-26-21-23-28-35-47-54(67-47)53(62)52(61)44(56)33-9-6-3/h11-12,14-15,42-48,52,54-57,61H,4-10,13,16-41H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC(O)C(O)CCCC)COC(=O)CCCCCCCC1OC1C(=O)C(O)C(O)CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O13/c1-4-7-10-11-12-13-14-15-16-17-18-19-24-31-38-51(60)65-42(40-63-49(58)36-29-25-20-22-27-34-46-48(66-46)39-45(57)43(55)32-8-5-2)41-64-50(59)37-30-26-21-23-28-35-47-54(67-47)53(62)52(61)44(56)33-9-6-3/h11-12,14-15,42-48,52,54-57,61H,4-10,13,16-41H2,1-3H3/b12-11?,15-14?/t42?,43?,44?,45?,46?,47?,48?,52?,54? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:24][CH2:31][CH2:38][C:51](=[O:60])[O:65][CH:42]([CH2:40][O:63][C:49]([CH2:36][CH2:29][CH2:25][CH2:20][CH2:22][CH2:27][CH2:34][CH:46]1[CH:48]([CH2:39][CH:45]([CH:43]([CH2:32][CH2:8][CH2:5][CH3:2])[OH:55])[OH:57])[O:66]1)=[O:58])[CH2:41][O:64][C:50]([CH2:37][CH2:30][CH2:26][CH2:21][CH2:23][CH2:28][CH2:35][CH:47]1[CH:54]([C:53]([CH:52]([CH:44]([CH2:33][CH2:9][CH2:6][CH3:3])[OH:56])[OH:61])=[O:62])[O:67]1)=[O:59] |
|