| Properties | Image |
|---|
| MNX_ID | MNXM1182867 |
 |
| reference | envipathM:...e6bd3117998f |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | WOXIZNDRRYAISN-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-6-22-30-44(58)53-46(67-53)32-24-17-14-20-26-34-50(60)64-40-42(65-51(61)35-27-18-12-10-8-7-9-11-15-21-29-41(56)28-4-2)39-63-49(59)33-25-19-13-16-23-31-45-47(66-45)38-48-54(68-48)52(62)43(57)36-37-55/h9,11,21-22,29-30,41-48,52-58,62H,3-8,10,12-20,23-28,31-40H2,1-2H3 |
| SMILES | CCCCC=CC(O)C1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1C(O)C(O)CCO)OC(=O)CCCCCCCC=CCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-6-22-30-44(58)53-46(67-53)32-24-17-14-20-26-34-50(60)64-40-42(65-51(61)35-27-18-12-10-8-7-9-11-15-21-29-41(56)28-4-2)39-63-49(59)33-25-19-13-16-23-31-45-47(66-45)38-48-54(68-48)52(62)43(57)36-37-55/h9,11,21-22,29-30,41-48,52-58,62H,3-8,10,12-20,23-28,31-40H2,1-2H3/b11-9?,29-21?,30-22?/t41?,42?,43?,44?,45?,46?,47?,48?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:22]=[CH:30][CH:44]([CH:53]1[CH:46]([CH2:32][CH2:24][CH2:17][CH2:14][CH2:20][CH2:26][CH2:34][C:50](=[O:60])[O:64][CH2:40][CH:42]([CH2:39][O:63][C:49]([CH2:33][CH2:25][CH2:19][CH2:13][CH2:16][CH2:23][CH2:31][CH:45]2[CH:47]([CH2:38][CH:48]3[CH:54]([CH:52]([CH:43]([CH2:36][CH2:37][OH:55])[OH:57])[OH:62])[O:68]3)[O:66]2)=[O:59])[O:65][C:51]([CH2:35][CH2:27][CH2:18][CH2:12][CH2:10][CH2:8][CH2:7][CH:9]=[CH:11][CH2:15][CH:21]=[CH:29][CH:41]([CH2:28][CH2:4][CH3:2])[OH:56])=[O:61])[O:67]1)[OH:58] |
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