| Properties | Image |
|---|
| MNX_ID | MNXM1194602 |
 |
| reference | envipathM:...d0ce26f417f3 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | LFSPLSYZHLTYOG-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-6-19-28-45(59)54-48(68-54)31-21-14-11-17-23-33-52(61)64-40-42(65-53(62)34-24-15-9-7-8-12-18-27-41(56)35-36-44(58)43(57)4-2)39-63-51(60)32-22-16-10-13-20-29-46-49(66-46)38-50-47(67-50)30-25-26-37-55/h18-19,27-28,35-36,41-50,54-59H,3-17,20-26,29-34,37-40H2,1-2H3 |
| SMILES | CCCCC=CC(O)C1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCCO)OC(=O)CCCCCCCC=CC(O)C=CC(O)C(O)CC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-6-19-28-45(59)54-48(68-54)31-21-14-11-17-23-33-52(61)64-40-42(65-53(62)34-24-15-9-7-8-12-18-27-41(56)35-36-44(58)43(57)4-2)39-63-51(60)32-22-16-10-13-20-29-46-49(66-46)38-50-47(67-50)30-25-26-37-55/h18-19,27-28,35-36,41-50,54-59H,3-17,20-26,29-34,37-40H2,1-2H3/b27-18?,28-19?,36-35?/t41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:19]=[CH:28][CH:45]([CH:54]1[CH:48]([CH2:31][CH2:21][CH2:14][CH2:11][CH2:17][CH2:23][CH2:33][C:52](=[O:61])[O:64][CH2:40][CH:42]([CH2:39][O:63][C:51]([CH2:32][CH2:22][CH2:16][CH2:10][CH2:13][CH2:20][CH2:29][CH:46]2[CH:49]([CH2:38][CH:50]3[CH:47]([CH2:30][CH2:25][CH2:26][CH2:37][OH:55])[O:67]3)[O:66]2)=[O:60])[O:65][C:53]([CH2:34][CH2:24][CH2:15][CH2:9][CH2:7][CH2:8][CH2:12][CH:18]=[CH:27][CH:41]([CH:35]=[CH:36][CH:44]([CH:43]([CH2:4][CH3:2])[OH:57])[OH:58])[OH:56])=[O:62])[O:68]1)[OH:59] |
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