| Properties | Image |
|---|
| MNX_ID | MNXM1195031 |
 |
| reference | envipathM:...bcf1582f9d9a |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | ALLVYYCAKGVYQN-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-4-7-10-12-13-14-15-16-17-18-19-20-24-29-38-51(57)63-42(40-61-50(56)37-28-25-21-23-27-35-47-49(66-47)39-48-46(65-48)33-9-6-3)41-62-54(60)53(59)52(58)43(55)32-30-31-36-45-44(64-45)34-26-22-11-8-5-2/h15-16,22,26,42-49,52,55,58H,4-14,17-21,23-25,27-41H2,1-3H3 |
| SMILES | CCCCC=CCC1OC1CCCCC(O)C(O)C(=O)C(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)CCCCCCCC=CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-4-7-10-12-13-14-15-16-17-18-19-20-24-29-38-51(57)63-42(40-61-50(56)37-28-25-21-23-27-35-47-49(66-47)39-48-46(65-48)33-9-6-3)41-62-54(60)53(59)52(58)43(55)32-30-31-36-45-44(64-45)34-26-22-11-8-5-2/h15-16,22,26,42-49,52,55,58H,4-14,17-21,23-25,27-41H2,1-3H3/b16-15?,26-22?/t42?,43?,44?,45?,46?,47?,48?,49?,52? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:12][CH2:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:24][CH2:29][CH2:38][C:51](=[O:57])[O:63][CH:42]([CH2:40][O:61][C:50]([CH2:37][CH2:28][CH2:25][CH2:21][CH2:23][CH2:27][CH2:35][CH:47]1[CH:49]([CH2:39][CH:48]2[CH:46]([CH2:33][CH2:9][CH2:6][CH3:3])[O:65]2)[O:66]1)=[O:56])[CH2:41][O:62][C:54]([C:53]([CH:52]([CH:43]([CH2:32][CH2:30][CH2:31][CH2:36][CH:45]1[CH:44]([CH2:34][CH:26]=[CH:22][CH2:11][CH2:8][CH2:5][CH3:2])[O:64]1)[OH:55])[OH:58])=[O:59])=[O:60] |
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