| Properties | Image |
|---|
| MNX_ID | MNXM1170625 |
 |
| reference | envipathM:...2d9a3e5385a8 |
| formula | C54H94O14 |
| global charge | 0 |
| mol weight | 967.332 |
| InChIKey | XVZJPJQXDJWARK-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O14/c1-4-7-9-19-28-42(56)29-20-14-11-10-12-16-25-37-52(61)66-43(39-64-51(60)36-24-17-13-15-23-35-48-50(68-48)38-49-47(67-49)34-8-5-2)40-65-54(63)53(62)46(59)32-22-18-21-31-44(57)45(58)33-26-30-41(55)27-6-3/h19-20,26,28-30,41-50,53,55-59,62H,4-18,21-25,27,31-40H2,1-3H3 |
| SMILES | CCCCC=CC(O)C=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(O)C(O)CCCCCC(O)C(O)CC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O14/c1-4-7-9-19-28-42(56)29-20-14-11-10-12-16-25-37-52(61)66-43(39-64-51(60)36-24-17-13-15-23-35-48-50(68-48)38-49-47(67-49)34-8-5-2)40-65-54(63)53(62)46(59)32-22-18-21-31-44(57)45(58)33-26-30-41(55)27-6-3/h19-20,26,28-30,41-50,53,55-59,62H,4-18,21-25,27,31-40H2,1-3H3/b28-19?,29-20?,30-26?/t41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,53? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:19]=[CH:28][CH:42]([CH:29]=[CH:20][CH2:14][CH2:11][CH2:10][CH2:12][CH2:16][CH2:25][CH2:37][C:52](=[O:61])[O:66][CH:43]([CH2:39][O:64][C:51]([CH2:36][CH2:24][CH2:17][CH2:13][CH2:15][CH2:23][CH2:35][CH:48]1[CH:50]([CH2:38][CH:49]2[CH:47]([CH2:34][CH2:8][CH2:5][CH3:2])[O:67]2)[O:68]1)=[O:60])[CH2:40][O:65][C:54]([CH:53]([CH:46]([CH2:32][CH2:22][CH2:18][CH2:21][CH2:31][CH:44]([CH:45]([CH2:33][CH:26]=[CH:30][CH:41]([CH2:27][CH2:6][CH3:3])[OH:55])[OH:58])[OH:57])[OH:59])[OH:62])=[O:63])[OH:56] |
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