| Properties | Image |
|---|
| MNX_ID | MNXM1186006 |
 |
| reference | envipathM:...d6d270250003 |
| formula | C54H94O12 |
| global charge | 0 |
| mol weight | 935.334 |
| InChIKey | QZMVYTIPNNQCRX-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O12/c1-3-5-6-15-24-34-48-49(65-48)35-25-18-14-21-27-38-53(60)63-43-45(64-54(61)39-28-19-12-10-8-7-9-11-16-22-32-44(56)31-4-2)42-62-52(59)37-26-20-13-17-23-33-46(57)47(58)41-51-50(66-51)36-29-30-40-55/h9,11,22,32,44-45,47-51,55-56,58H,3-8,10,12-21,23-31,33-43H2,1-2H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC(=O)C(O)CC1OC1CCCCO)OC(=O)CCCCCCCC=CCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O12/c1-3-5-6-15-24-34-48-49(65-48)35-25-18-14-21-27-38-53(60)63-43-45(64-54(61)39-28-19-12-10-8-7-9-11-16-22-32-44(56)31-4-2)42-62-52(59)37-26-20-13-17-23-33-46(57)47(58)41-51-50(66-51)36-29-30-40-55/h9,11,22,32,44-45,47-51,55-56,58H,3-8,10,12-21,23-31,33-43H2,1-2H3/b11-9?,32-22?/t44?,45?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:15][CH2:24][CH2:34][CH:48]1[CH:49]([CH2:35][CH2:25][CH2:18][CH2:14][CH2:21][CH2:27][CH2:38][C:53](=[O:60])[O:63][CH2:43][CH:45]([CH2:42][O:62][C:52]([CH2:37][CH2:26][CH2:20][CH2:13][CH2:17][CH2:23][CH2:33][C:46]([CH:47]([CH2:41][CH:51]2[CH:50]([CH2:36][CH2:29][CH2:30][CH2:40][OH:55])[O:66]2)[OH:58])=[O:57])=[O:59])[O:64][C:54]([CH2:39][CH2:28][CH2:19][CH2:12][CH2:10][CH2:8][CH2:7][CH:9]=[CH:11][CH2:16][CH:22]=[CH:32][CH:44]([CH2:31][CH2:4][CH3:2])[OH:56])=[O:61])[O:65]1 |
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