| Properties | Image |
|---|
| MNX_ID | MNXM1193154 |
 |
| reference | envipathM:...722dc9669edd |
| formula | C54H94O11 |
| global charge | 0 |
| mol weight | 919.335 |
| InChIKey | CHPGMJUNMQVVHC-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H94O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-26-34-41-54(61)64-45(44-63-53(60)40-33-28-22-25-31-38-51-50(65-51)37-30-23-11-8-5-2)43-62-52(59)39-32-27-21-24-29-36-47(56)49(58)42-48(57)46(55)35-9-6-3/h12-13,15-16,23,30,45-46,48-51,55,57-58H,4-11,14,17-22,24-29,31-44H2,1-3H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC(=O)C(O)CC(O)C(O)CCCC)COC(=O)CCCCCCCC1OC1CC=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-26-34-41-54(61)64-45(44-63-53(60)40-33-28-22-25-31-38-51-50(65-51)37-30-23-11-8-5-2)43-62-52(59)39-32-27-21-24-29-36-47(56)49(58)42-48(57)46(55)35-9-6-3/h12-13,15-16,23,30,45-46,48-51,55,57-58H,4-11,14,17-22,24-29,31-44H2,1-3H3/b13-12?,16-15?,30-23?/t45?,46?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH:12]=[CH:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:26][CH2:34][CH2:41][C:54](=[O:61])[O:64][CH:45]([CH2:43][O:62][C:52]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:29][CH2:36][C:47]([CH:49]([CH2:42][CH:48]([CH:46]([CH2:35][CH2:9][CH2:6][CH3:3])[OH:55])[OH:57])[OH:58])=[O:56])=[O:59])[CH2:44][O:63][C:53]([CH2:40][CH2:33][CH2:28][CH2:22][CH2:25][CH2:31][CH2:38][CH:51]1[CH:50]([CH2:37][CH:30]=[CH:23][CH2:11][CH2:8][CH2:5][CH3:2])[O:65]1)=[O:60] |
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