| Properties | Image |
|---|
| MNX_ID | MNXM1183270 |
 |
| reference | envipathM:...6bfc717a9d91 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | VZBZEUSNPDVOMY-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-4-7-30-46-49(66-46)37-50-47(67-50)31-23-17-13-19-25-33-51(60)63-38-41(65-54(62)45(59)29-22-16-12-10-8-9-11-15-21-28-43(57)42(56)6-3)39-64-52(61)34-26-20-14-18-24-32-48-53(68-48)44(58)36-35-40(55)27-5-2/h9,11,21,28,35-36,40-50,53,55-59H,4-8,10,12-20,22-27,29-34,37-39H2,1-3H3 |
| SMILES | CCCCC1OC1CC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1C(O)C=CC(O)CCC)OC(=O)C(O)CCCCCCC=CCC=CC(O)C(O)CC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-4-7-30-46-49(66-46)37-50-47(67-50)31-23-17-13-19-25-33-51(60)63-38-41(65-54(62)45(59)29-22-16-12-10-8-9-11-15-21-28-43(57)42(56)6-3)39-64-52(61)34-26-20-14-18-24-32-48-53(68-48)44(58)36-35-40(55)27-5-2/h9,11,21,28,35-36,40-50,53,55-59H,4-8,10,12-20,22-27,29-34,37-39H2,1-3H3/b11-9?,28-21?,36-35?/t40?,41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,53? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:30][CH:46]1[CH:49]([CH2:37][CH:50]2[CH:47]([CH2:31][CH2:23][CH2:17][CH2:13][CH2:19][CH2:25][CH2:33][C:51](=[O:60])[O:63][CH2:38][CH:41]([CH2:39][O:64][C:52]([CH2:34][CH2:26][CH2:20][CH2:14][CH2:18][CH2:24][CH2:32][CH:48]3[CH:53]([CH:44]([CH:36]=[CH:35][CH:40]([CH2:27][CH2:5][CH3:2])[OH:55])[OH:58])[O:68]3)=[O:61])[O:65][C:54]([CH:45]([CH2:29][CH2:22][CH2:16][CH2:12][CH2:10][CH2:8][CH:9]=[CH:11][CH2:15][CH:21]=[CH:28][CH:43]([CH:42]([CH2:6][CH3:3])[OH:56])[OH:57])[OH:59])=[O:62])[O:67]2)[O:66]1 |
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