| Properties | Image |
|---|
| MNX_ID | MNXM1173650 |
 |
| reference | envipathM:...40e1348e15c7 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | AYECUYHROBYNEZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-10-18-30-46-47(66-46)31-19-11-8-13-21-33-52(60)63-39-44(40-64-53(61)34-22-14-9-12-20-32-49-51(68-49)37-50-48(67-50)29-6-4-2)65-54(62)45(59)28-17-15-16-25-41(56)35-36-42(57)26-23-24-27-43(58)38-55/h10,18,23,26,35-36,41-51,55-59H,3-9,11-17,19-22,24-25,27-34,37-40H2,1-2H3 |
| SMILES | CCCCC=CCC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC)OC(=O)C(O)CCCCCC(O)C=CC(O)C=CCCC(O)CO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-10-18-30-46-47(66-46)31-19-11-8-13-21-33-52(60)63-39-44(40-64-53(61)34-22-14-9-12-20-32-49-51(68-49)37-50-48(67-50)29-6-4-2)65-54(62)45(59)28-17-15-16-25-41(56)35-36-42(57)26-23-24-27-43(58)38-55/h10,18,23,26,35-36,41-51,55-59H,3-9,11-17,19-22,24-25,27-34,37-40H2,1-2H3/b18-10?,26-23?,36-35?/t41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:10]=[CH:18][CH2:30][CH:46]1[CH:47]([CH2:31][CH2:19][CH2:11][CH2:8][CH2:13][CH2:21][CH2:33][C:52](=[O:60])[O:63][CH2:39][CH:44]([CH2:40][O:64][C:53]([CH2:34][CH2:22][CH2:14][CH2:9][CH2:12][CH2:20][CH2:32][CH:49]2[CH:51]([CH2:37][CH:50]3[CH:48]([CH2:29][CH2:6][CH2:4][CH3:2])[O:67]3)[O:68]2)=[O:61])[O:65][C:54]([CH:45]([CH2:28][CH2:17][CH2:15][CH2:16][CH2:25][CH:41]([CH:35]=[CH:36][CH:42]([CH:26]=[CH:23][CH2:24][CH2:27][CH:43]([CH2:38][OH:55])[OH:58])[OH:57])[OH:56])[OH:59])=[O:62])[O:66]1 |
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