| Properties | Image |
|---|
| MNX_ID | MNXM1313799 |
 |
| reference | envipathM:...222f29c2d3cd |
| formula | C54H94O13 |
| global charge | 0 |
| mol weight | 951.333 |
| InChIKey | OKZUFIZBEFGMSR-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O13/c1-3-5-7-9-10-11-12-13-14-15-16-17-21-26-37-51(59)64-42(40-62-50(58)36-25-22-18-20-24-34-46-45(65-46)33-23-19-8-6-4-2)41-63-54(61)44(57)32-28-27-31-43(56)52(60)53-49(67-53)39-48-47(66-48)35-29-30-38-55/h9-10,12-13,42-49,52-53,55-57,60H,3-8,11,14-41H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CCCCCCC)COC(=O)C(O)CCCCC(O)C(O)C1OC1CC1OC1CCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H94O13/c1-3-5-7-9-10-11-12-13-14-15-16-17-21-26-37-51(59)64-42(40-62-50(58)36-25-22-18-20-24-34-46-45(65-46)33-23-19-8-6-4-2)41-63-54(61)44(57)32-28-27-31-43(56)52(60)53-49(67-53)39-48-47(66-48)35-29-30-38-55/h9-10,12-13,42-49,52-53,55-57,60H,3-8,11,14-41H2,1-2H3/b10-9?,13-12?/t42?,43?,44?,45?,46?,47?,48?,49?,52?,53? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:11][CH:12]=[CH:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:21][CH2:26][CH2:37][C:51](=[O:59])[O:64][CH:42]([CH2:40][O:62][C:50]([CH2:36][CH2:25][CH2:22][CH2:18][CH2:20][CH2:24][CH2:34][CH:46]1[CH:45]([CH2:33][CH2:23][CH2:19][CH2:8][CH2:6][CH2:4][CH3:2])[O:65]1)=[O:58])[CH2:41][O:63][C:54]([CH:44]([CH2:32][CH2:28][CH2:27][CH2:31][CH:43]([CH:52]([CH:53]1[CH:49]([CH2:39][CH:48]2[CH:47]([CH2:35][CH2:29][CH2:30][CH2:38][OH:55])[O:66]2)[O:67]1)[OH:60])[OH:56])[OH:57])=[O:61] |
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