| Properties | Image |
|---|
| MNX_ID | MNXM1138286 |
 |
| reference | envipathM:...e49e02f54f15 |
| formula | C54H96O14 |
| global charge | 0 |
| mol weight | 969.348 |
| InChIKey | DEZFXKJYNINMEB-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O14/c1-3-5-7-19-26-33-44(56)45(57)34-27-20-18-22-29-37-48(59)65-41-43(67-50(61)39-31-21-16-14-12-10-8-9-11-13-15-17-25-32-40-55)42-66-49(60)38-30-24-23-28-35-46(58)51(62)52(63)53(64)54-47(68-54)36-6-4-2/h8-9,13,15,19,26,43-47,51-58,62-64H,3-7,10-12,14,16-18,20-25,27-42H2,1-2H3 |
| SMILES | CCCCC=CCC(O)C(O)CCCCCCCC(=O)OCC(COC(=O)CCCCCCC(O)C(O)C(O)C(O)C1OC1CCCC)OC(=O)CCCCCCCC=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H96O14/c1-3-5-7-19-26-33-44(56)45(57)34-27-20-18-22-29-37-48(59)65-41-43(67-50(61)39-31-21-16-14-12-10-8-9-11-13-15-17-25-32-40-55)42-66-49(60)38-30-24-23-28-35-46(58)51(62)52(63)53(64)54-47(68-54)36-6-4-2/h8-9,13,15,19,26,43-47,51-58,62-64H,3-7,10-12,14,16-18,20-25,27-42H2,1-2H3/b9-8?,15-13?,26-19?/t43?,44?,45?,46?,47?,51?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:19]=[CH:26][CH2:33][CH:44]([CH:45]([CH2:34][CH2:27][CH2:20][CH2:18][CH2:22][CH2:29][CH2:37][C:48](=[O:59])[O:65][CH2:41][CH:43]([CH2:42][O:66][C:49]([CH2:38][CH2:30][CH2:24][CH2:23][CH2:28][CH2:35][CH:46]([CH:51]([CH:52]([CH:53]([CH:54]1[CH:47]([CH2:36][CH2:6][CH2:4][CH3:2])[O:68]1)[OH:64])[OH:63])[OH:62])[OH:58])=[O:60])[O:67][C:50]([CH2:39][CH2:31][CH2:21][CH2:16][CH2:14][CH2:12][CH2:10][CH:8]=[CH:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:25][CH2:32][CH2:40][OH:55])=[O:61])[OH:57])[OH:56] |
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