| Properties | Image |
|---|
| MNX_ID | MNXM1176661 |
 |
| reference | envipathM:...2f8ec3c27187 |
| formula | C54H92O12 |
| global charge | 0 |
| mol weight | 933.318 |
| InChIKey | GWFNIBCLYOUWJI-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O12/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-28-36-53(60)63-44(41-61-51(58)34-26-22-17-19-24-32-47-50(65-47)40-49-46(64-49)31-6-4-2)42-62-52(59)35-27-23-18-20-25-33-48-54(66-48)45(57)38-37-43(56)30-29-39-55/h11-12,37-39,43-50,54,56-57H,3-10,13-36,40-42H2,1-2H3 |
| SMILES | CCCCCCCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)COC(=O)CCCCCCCC1OC1C(O)C=CC(O)CCC=O |
MNX internals
| InChI (mnx) | InChI=1/C54H92O12/c1-3-5-7-8-9-10-11-12-13-14-15-16-21-28-36-53(60)63-44(41-61-51(58)34-26-22-17-19-24-32-47-50(65-47)40-49-46(64-49)31-6-4-2)42-62-52(59)35-27-23-18-20-25-33-48-54(66-48)45(57)38-37-43(56)30-29-39-55/h11-12,37-39,43-50,54,56-57H,3-10,13-36,40-42H2,1-2H3/b12-11?,38-37?/t43?,44?,45?,46?,47?,48?,49?,50?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:21][CH2:28][CH2:36][C:53](=[O:60])[O:63][CH:44]([CH2:41][O:61][C:51]([CH2:34][CH2:26][CH2:22][CH2:17][CH2:19][CH2:24][CH2:32][CH:47]1[CH:50]([CH2:40][CH:49]2[CH:46]([CH2:31][CH2:6][CH2:4][CH3:2])[O:64]2)[O:65]1)=[O:58])[CH2:42][O:62][C:52]([CH2:35][CH2:27][CH2:23][CH2:18][CH2:20][CH2:25][CH2:33][CH:48]1[CH:54]([CH:45]([CH:38]=[CH:37][CH:43]([CH2:30][CH2:29][CH:39]=[O:55])[OH:56])[OH:57])[O:66]1)=[O:59] |
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