| Properties | Image |
|---|
| MNX_ID | MNXM1193960 |
 |
| reference | envipathM:...0d80f6eb2fe1 |
| formula | C54H94O14 |
| global charge | 0 |
| mol weight | 967.332 |
| InChIKey | AWFZZHFMCCCAAU-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O14/c1-3-5-7-8-9-10-11-12-13-14-15-18-25-34-46(59)54(63)66-42(40-64-51(60)37-29-21-16-20-28-36-48-50(68-48)39-49-47(67-49)35-6-4-2)41-65-53(62)45(58)33-27-23-26-32-44(57)52(61)43(56)31-24-19-17-22-30-38-55/h8-9,11-12,19,24,42-50,52,55-59,61H,3-7,10,13-18,20-23,25-41H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(O)CCCCCC(O)C(O)C(O)CC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H94O14/c1-3-5-7-8-9-10-11-12-13-14-15-18-25-34-46(59)54(63)66-42(40-64-51(60)37-29-21-16-20-28-36-48-50(68-48)39-49-47(67-49)35-6-4-2)41-65-53(62)45(58)33-27-23-26-32-44(57)52(61)43(56)31-24-19-17-22-30-38-55/h8-9,11-12,19,24,42-50,52,55-59,61H,3-7,10,13-18,20-23,25-41H2,1-2H3/b9-8?,12-11?,24-19?/t42?,43?,44?,45?,46?,47?,48?,49?,50?,52? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:18][CH2:25][CH2:34][CH:46]([C:54](=[O:63])[O:66][CH:42]([CH2:40][O:64][C:51]([CH2:37][CH2:29][CH2:21][CH2:16][CH2:20][CH2:28][CH2:36][CH:48]1[CH:50]([CH2:39][CH:49]2[CH:47]([CH2:35][CH2:6][CH2:4][CH3:2])[O:67]2)[O:68]1)=[O:60])[CH2:41][O:65][C:53]([CH:45]([CH2:33][CH2:27][CH2:23][CH2:26][CH2:32][CH:44]([CH:52]([CH:43]([CH2:31][CH:24]=[CH:19][CH2:17][CH2:22][CH2:30][CH2:38][OH:55])[OH:56])[OH:61])[OH:57])[OH:58])=[O:62])[OH:59] |
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