| Properties | Image |
|---|
| MNX_ID | MNXM1175567 |
 |
| reference | envipathM:...59910d71605b |
| formula | C54H94O14 |
| global charge | 0 |
| mol weight | 967.332 |
| InChIKey | ANSAKBSEDGJPTN-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O14/c1-3-5-6-17-26-34-47-48(67-47)35-27-19-16-20-28-36-50(60)64-40-42(66-54(63)45(58)33-25-18-14-12-10-8-7-9-11-13-15-23-30-38-55)41-65-51(61)37-29-22-21-24-32-43(56)52(62)46(59)39-49-53(68-49)44(57)31-4-2/h7-8,11,13,17,26,42-49,52-53,55-59,62H,3-6,9-10,12,14-16,18-25,27-41H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCC(O)C(O)C(O)CC1OC1C(O)CCC)OC(=O)C(O)CCCCCCC=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H94O14/c1-3-5-6-17-26-34-47-48(67-47)35-27-19-16-20-28-36-50(60)64-40-42(66-54(63)45(58)33-25-18-14-12-10-8-7-9-11-13-15-23-30-38-55)41-65-51(61)37-29-22-21-24-32-43(56)52(62)46(59)39-49-53(68-49)44(57)31-4-2/h7-8,11,13,17,26,42-49,52-53,55-59,62H,3-6,9-10,12,14-16,18-25,27-41H2,1-2H3/b8-7?,13-11?,26-17?/t42?,43?,44?,45?,46?,47?,48?,49?,52?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:17]=[CH:26][CH2:34][CH:47]1[CH:48]([CH2:35][CH2:27][CH2:19][CH2:16][CH2:20][CH2:28][CH2:36][C:50](=[O:60])[O:64][CH2:40][CH:42]([CH2:41][O:65][C:51]([CH2:37][CH2:29][CH2:22][CH2:21][CH2:24][CH2:32][CH:43]([CH:52]([CH:46]([CH2:39][CH:49]2[CH:53]([CH:44]([CH2:31][CH2:4][CH3:2])[OH:57])[O:68]2)[OH:59])[OH:62])[OH:56])=[O:61])[O:66][C:54]([CH:45]([CH2:33][CH2:25][CH2:18][CH2:14][CH2:12][CH2:10][CH:8]=[CH:7][CH2:9][CH:11]=[CH:13][CH2:15][CH2:23][CH2:30][CH2:38][OH:55])[OH:58])=[O:63])[O:67]1 |
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