| Properties | Image |
|---|
| MNX_ID | MNXM1185159 |
 |
| reference | envipathM:...9b3b4191302a |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | JXEKEBGDVNKUCV-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-22-31-38-51(60)63-42(40-61-49(58)36-29-23-20-21-28-35-46-52(64-46)44(56)33-26-10-8-5-2)41-62-50(59)37-30-25-24-27-34-45(57)54-48(66-54)39-47-53(65-47)43(55)32-6-3/h11-12,26,33,42,44-48,52-54,56-57H,4-10,13-25,27-32,34-41H2,1-3H3 |
| SMILES | CCCCC=CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1C(O)C=CCCCC)COC(=O)CCCCCCC(O)C1OC1CC1OC1C(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-4-7-9-11-12-13-14-15-16-17-18-19-22-31-38-51(60)63-42(40-61-49(58)36-29-23-20-21-28-35-46-52(64-46)44(56)33-26-10-8-5-2)41-62-50(59)37-30-25-24-27-34-45(57)54-48(66-54)39-47-53(65-47)43(55)32-6-3/h11-12,26,33,42,44-48,52-54,56-57H,4-10,13-25,27-32,34-41H2,1-3H3/b12-11?,33-26?/t42?,44?,45?,46?,47?,48?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:22][CH2:31][CH2:38][C:51](=[O:60])[O:63][CH:42]([CH2:40][O:61][C:49]([CH2:36][CH2:29][CH2:23][CH2:20][CH2:21][CH2:28][CH2:35][CH:46]1[CH:52]([CH:44]([CH:33]=[CH:26][CH2:10][CH2:8][CH2:5][CH3:2])[OH:56])[O:64]1)=[O:58])[CH2:41][O:62][C:50]([CH2:37][CH2:30][CH2:25][CH2:24][CH2:27][CH2:34][CH:45]([CH:54]1[CH:48]([CH2:39][CH:47]2[CH:53]([C:43]([CH2:32][CH2:6][CH3:3])=[O:55])[O:65]2)[O:66]1)[OH:57])=[O:59] |
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