| Properties | Image |
|---|
| MNX_ID | MNXM1170910 |
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| reference | envipathM:...a673476218d4 |
| formula | C54H88O11 |
| global charge | 0 |
| mol weight | 913.287 |
| InChIKey | FWPMEMKHBDFHFI-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H88O11/c1-4-7-10-23-31-43(55)32-24-17-13-12-14-20-30-39-53(59)62-44(42-61-52(58)38-29-22-16-19-27-36-48-54(65-48)45(56)33-25-11-8-5-2)41-60-51(57)37-28-21-15-18-26-35-47-50(64-47)40-49-46(63-49)34-9-6-3/h23-25,31-33,44,46-50,54H,4-22,26-30,34-42H2,1-3H3 |
| SMILES | CCCCC=CC(=O)C=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)CCCCCCCC1OC1C(=O)C=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H88O11/c1-4-7-10-23-31-43(55)32-24-17-13-12-14-20-30-39-53(59)62-44(42-61-52(58)38-29-22-16-19-27-36-48-54(65-48)45(56)33-25-11-8-5-2)41-60-51(57)37-28-21-15-18-26-35-47-50(64-47)40-49-46(63-49)34-9-6-3/h23-25,31-33,44,46-50,54H,4-22,26-30,34-42H2,1-3H3/b31-23?,32-24?,33-25?/t44?,46?,47?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:23]=[CH:31][C:43]([CH:32]=[CH:24][CH2:17][CH2:13][CH2:12][CH2:14][CH2:20][CH2:30][CH2:39][C:53](=[O:59])[O:62][CH:44]([CH2:41][O:60][C:51]([CH2:37][CH2:28][CH2:21][CH2:15][CH2:18][CH2:26][CH2:35][CH:47]1[CH:50]([CH2:40][CH:49]2[CH:46]([CH2:34][CH2:9][CH2:6][CH3:3])[O:63]2)[O:64]1)=[O:57])[CH2:42][O:61][C:52]([CH2:38][CH2:29][CH2:22][CH2:16][CH2:19][CH2:27][CH2:36][CH:48]1[CH:54]([C:45]([CH:33]=[CH:25][CH2:11][CH2:8][CH2:5][CH3:2])=[O:56])[O:65]1)=[O:58])=[O:55] |
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