| Properties | Image |
|---|
| MNX_ID | MNXM1170780 |
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| reference | envipathM:...8139a51338d1 |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | MZPQKQFWTPBMPJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-24-32-38-51(59)63-42(41-62-50(58)37-31-26-21-23-29-35-46-53(65-46)44(56)33-27-10-8-5-2)40-61-49(57)36-30-25-20-22-28-34-45-47(64-45)39-48-54(66-48)52(60)43(55)6-3/h11-12,27,33,42-48,53-56H,4-10,13-26,28-32,34-41H2,1-3H3 |
| SMILES | CCCCC=CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1C(=O)C(O)CC)COC(=O)CCCCCCCC1OC1C(O)C=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-24-32-38-51(59)63-42(41-62-50(58)37-31-26-21-23-29-35-46-53(65-46)44(56)33-27-10-8-5-2)40-61-49(57)36-30-25-20-22-28-34-45-47(64-45)39-48-54(66-48)52(60)43(55)6-3/h11-12,27,33,42-48,53-56H,4-10,13-26,28-32,34-41H2,1-3H3/b12-11?,33-27?/t42?,43?,44?,45?,46?,47?,48?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:24][CH2:32][CH2:38][C:51](=[O:59])[O:63][CH:42]([CH2:40][O:61][C:49]([CH2:36][CH2:30][CH2:25][CH2:20][CH2:22][CH2:28][CH2:34][CH:45]1[CH:47]([CH2:39][CH:48]2[CH:54]([C:52]([CH:43]([CH2:6][CH3:3])[OH:55])=[O:60])[O:66]2)[O:64]1)=[O:57])[CH2:41][O:62][C:50]([CH2:37][CH2:31][CH2:26][CH2:21][CH2:23][CH2:29][CH2:35][CH:46]1[CH:53]([CH:44]([CH:33]=[CH:27][CH2:10][CH2:8][CH2:5][CH3:2])[OH:56])[O:65]1)=[O:58] |
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