| Properties | Image |
|---|
| MNX_ID | MNXM1193786 |
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| reference | envipathM:...7b441df90795 |
| formula | C54H92O11 |
| global charge | 0 |
| mol weight | 917.319 |
| InChIKey | YJFYJXBRKQPWAQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O11/c1-4-7-10-15-24-33-46-47(63-46)34-25-17-13-19-27-36-52(57)60-41-45(62-54(59)38-29-21-12-16-23-31-44(56)39-43(55)30-22-11-8-5-2)42-61-53(58)37-28-20-14-18-26-35-49-51(65-49)40-50-48(64-50)32-9-6-3/h15,22,24,30,44-51,56H,4-14,16-21,23,25-29,31-42H2,1-3H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCC(O)CC(=O)C=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O11/c1-4-7-10-15-24-33-46-47(63-46)34-25-17-13-19-27-36-52(57)60-41-45(62-54(59)38-29-21-12-16-23-31-44(56)39-43(55)30-22-11-8-5-2)42-61-53(58)37-28-20-14-18-26-35-49-51(65-49)40-50-48(64-50)32-9-6-3/h15,22,24,30,44-51,56H,4-14,16-21,23,25-29,31-42H2,1-3H3/b24-15?,30-22?/t44?,45?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:15]=[CH:24][CH2:33][CH:46]1[CH:47]([CH2:34][CH2:25][CH2:17][CH2:13][CH2:19][CH2:27][CH2:36][C:52](=[O:57])[O:60][CH2:41][CH:45]([CH2:42][O:61][C:53]([CH2:37][CH2:28][CH2:20][CH2:14][CH2:18][CH2:26][CH2:35][CH:49]2[CH:51]([CH2:40][CH:50]3[CH:48]([CH2:32][CH2:9][CH2:6][CH3:3])[O:64]3)[O:65]2)=[O:58])[O:62][C:54]([CH2:38][CH2:29][CH2:21][CH2:12][CH2:16][CH2:23][CH2:31][CH:44]([CH2:39][C:43]([CH:30]=[CH:22][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55])[OH:56])=[O:59])[O:63]1 |
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