| Properties | Image |
|---|
| MNX_ID | MNXM1196809 |
 |
| reference | envipathM:...01a0ea94726e |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | FXWGPZYVAZSBQB-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-15-24-42(57)35-36-43(58)25-16-11-14-21-34-53(61)65-44(39-63-52(60)33-20-10-8-9-18-31-49-51(68-49)38-50-48(67-50)29-6-4-2)40-64-54(62)45(59)28-17-12-13-19-30-46-47(66-46)32-22-26-41(56)27-23-37-55/h15,22,24,26,35-36,41-51,55-59H,3-14,16-21,23,25,27-34,37-40H2,1-2H3 |
| SMILES | CCCCC=CC(O)C=CC(O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(O)CCCCCCC1OC1CC=CC(O)CCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-15-24-42(57)35-36-43(58)25-16-11-14-21-34-53(61)65-44(39-63-52(60)33-20-10-8-9-18-31-49-51(68-49)38-50-48(67-50)29-6-4-2)40-64-54(62)45(59)28-17-12-13-19-30-46-47(66-46)32-22-26-41(56)27-23-37-55/h15,22,24,26,35-36,41-51,55-59H,3-14,16-21,23,25,27-34,37-40H2,1-2H3/b24-15?,26-22?,36-35?/t41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:15]=[CH:24][CH:42]([CH:35]=[CH:36][CH:43]([CH2:25][CH2:16][CH2:11][CH2:14][CH2:21][CH2:34][C:53](=[O:61])[O:65][CH:44]([CH2:39][O:63][C:52]([CH2:33][CH2:20][CH2:10][CH2:8][CH2:9][CH2:18][CH2:31][CH:49]1[CH:51]([CH2:38][CH:50]2[CH:48]([CH2:29][CH2:6][CH2:4][CH3:2])[O:67]2)[O:68]1)=[O:60])[CH2:40][O:64][C:54]([CH:45]([CH2:28][CH2:17][CH2:12][CH2:13][CH2:19][CH2:30][CH:46]1[CH:47]([CH2:32][CH:22]=[CH:26][CH:41]([CH2:27][CH2:23][CH2:37][OH:55])[OH:56])[O:66]1)[OH:59])=[O:62])[OH:58])[OH:57] |
|