| Properties | Image |
|---|
| MNX_ID | MNXM1178639 |
 |
| reference | envipathM:...63a66ccf4457 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | RNVNPENYBWDPJE-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-19-24-32-43-44(66-43)33-25-20-18-22-26-35-49(57)63-39-41(65-50(58)36-27-21-16-14-12-10-8-9-11-13-15-17-23-28-37-55)40-64-54(62)53(61)52(60)51(59)42(56)30-29-34-46-48(68-46)38-47-45(67-47)31-6-4-2/h8-9,13,15,19,24,41-48,51-53,55-56,59-61H,3-7,10-12,14,16-18,20-23,25-40H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)C(O)C(O)C(O)C(O)CCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCC=CCC=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-19-24-32-43-44(66-43)33-25-20-18-22-26-35-49(57)63-39-41(65-50(58)36-27-21-16-14-12-10-8-9-11-13-15-17-23-28-37-55)40-64-54(62)53(61)52(60)51(59)42(56)30-29-34-46-48(68-46)38-47-45(67-47)31-6-4-2/h8-9,13,15,19,24,41-48,51-53,55-56,59-61H,3-7,10-12,14,16-18,20-23,25-40H2,1-2H3/b9-8?,15-13?,24-19?/t41?,42?,43?,44?,45?,46?,47?,48?,51?,52?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:19]=[CH:24][CH2:32][CH:43]1[CH:44]([CH2:33][CH2:25][CH2:20][CH2:18][CH2:22][CH2:26][CH2:35][C:49](=[O:57])[O:63][CH2:39][CH:41]([CH2:40][O:64][C:54]([CH:53]([CH:52]([CH:51]([CH:42]([CH2:30][CH2:29][CH2:34][CH:46]2[CH:48]([CH2:38][CH:47]3[CH:45]([CH2:31][CH2:6][CH2:4][CH3:2])[O:67]3)[O:68]2)[OH:56])[OH:59])[OH:60])[OH:61])=[O:62])[O:65][C:50]([CH2:36][CH2:27][CH2:21][CH2:16][CH2:14][CH2:12][CH2:10][CH:8]=[CH:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:23][CH2:28][CH2:37][OH:55])=[O:58])[O:66]1 |
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