| Properties | Image |
|---|
| MNX_ID | MNXM1184832 |
 |
| reference | envipathM:...481cbf94294c |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | GXLXCTYCEIRZLM-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-26-36-50(60)65-41(39-63-49(59)35-25-20-17-18-24-34-46-48(67-46)38-47-45(66-47)33-6-4-2)40-64-54(62)44(58)32-28-27-30-42(56)51(61)53-52(68-53)43(57)31-23-21-22-29-37-55/h8-9,11-12,23,31,41-48,51-53,55-58,61H,3-7,10,13-22,24-30,32-40H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)C(O)CCCCC(O)C(O)C1OC1C(O)C=CCCCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-8-9-10-11-12-13-14-15-16-19-26-36-50(60)65-41(39-63-49(59)35-25-20-17-18-24-34-46-48(67-46)38-47-45(66-47)33-6-4-2)40-64-54(62)44(58)32-28-27-30-42(56)51(61)53-52(68-53)43(57)31-23-21-22-29-37-55/h8-9,11-12,23,31,41-48,51-53,55-58,61H,3-7,10,13-22,24-30,32-40H2,1-2H3/b9-8?,12-11?,31-23?/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:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:26][CH2:36][C:50](=[O:60])[O:65][CH:41]([CH2:39][O:63][C:49]([CH2:35][CH2:25][CH2:20][CH2:17][CH2:18][CH2:24][CH2:34][CH:46]1[CH:48]([CH2:38][CH:47]2[CH:45]([CH2:33][CH2:6][CH2:4][CH3:2])[O:66]2)[O:67]1)=[O:59])[CH2:40][O:64][C:54]([CH:44]([CH2:32][CH2:28][CH2:27][CH2:30][CH:42]([CH:51]([CH:53]1[CH:52]([CH:43]([CH:31]=[CH:23][CH2:21][CH2:22][CH2:29][CH2:37][OH:55])[OH:57])[O:68]1)[OH:61])[OH:56])[OH:58])=[O:62] |
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