| Properties | Image |
|---|
| MNX_ID | MNXM1185894 |
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| reference | envipathM:...b1945f8cd4ff |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | DCLNXIJZSNCMHN-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-3-5-7-20-28-36-48-49(64-48)37-29-22-19-25-31-39-53(59)62-44-45(63-54(60)40-32-23-16-14-12-10-8-9-11-13-15-17-26-33-41-55)43-61-52(58)38-30-24-18-21-27-34-46(56)47(57)42-51-50(65-51)35-6-4-2/h8-9,13,15,41,45-51,56-57H,3-7,10-12,14,16-40,42-44H2,1-2H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC(O)C(O)CC1OC1CCCC)OC(=O)CCCCCCCC=CCC=CCCCC=O |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-3-5-7-20-28-36-48-49(64-48)37-29-22-19-25-31-39-53(59)62-44-45(63-54(60)40-32-23-16-14-12-10-8-9-11-13-15-17-26-33-41-55)43-61-52(58)38-30-24-18-21-27-34-46(56)47(57)42-51-50(65-51)35-6-4-2/h8-9,13,15,41,45-51,56-57H,3-7,10-12,14,16-40,42-44H2,1-2H3/b9-8?,15-13?/t45?,46?,47?,48?,49?,50?,51? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:20][CH2:28][CH2:36][CH:48]1[CH:49]([CH2:37][CH2:29][CH2:22][CH2:19][CH2:25][CH2:31][CH2:39][C:53](=[O:59])[O:62][CH2:44][CH:45]([CH2:43][O:61][C:52]([CH2:38][CH2:30][CH2:24][CH2:18][CH2:21][CH2:27][CH2:34][CH:46]([CH:47]([CH2:42][CH:51]2[CH:50]([CH2:35][CH2:6][CH2:4][CH3:2])[O:65]2)[OH:57])[OH:56])=[O:58])[O:63][C:54]([CH2:40][CH2:32][CH2:23][CH2:16][CH2:14][CH2:12][CH2:10][CH:8]=[CH:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:26][CH2:33][CH:41]=[O:55])=[O:60])[O:64]1 |
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