| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1376505 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C28H32O14 |
| charge | 0 |
| mass | 592.55 |
| reference | lipidmapsM:LMPK12110435 |
| InChIKey | JIKPWRRUSIBFLE-KVQGGKNTSA-N |
| InChI | InChI=1S/C28H32O14/c1-10-20(32)23(35)25(37)28(39-10)42-27-24(36)21(33)17(9-29)41-26(27)19-14(31)8-16-18(22(19)34)13(30)7-15(40-16)11-3-5-12(38-2)6-4-11/h3-8,10,17,20-21,23-29,31-37H,9H2,1-2H3/t10-,17+,20-,21+,23+,24-,25+,26-,27+,28-/m0/s1 |
| SMILES | [CH3:1][C@H:10]1[C@H:20]([OH:32])[C@@H:23]([OH:35])[C@@H:25]([OH:37])[C@H:28]([O:42][C@@H:27]2[C@@H:24]([OH:36])[C@H:21]([OH:33])[C@@H:17]([CH2:9][OH:29])[O:41][C@H:26]2[c:19]2[c:14]([OH:31])[cH:8][c:16]3[c:18]([c:13](=[O:30])[cH:7][c:15](-[c:11]4[cH:3][cH:5][c:12]([O:38][CH3:2])[cH:6][cH:4]4)[o:40]3)[c:22]2[OH:34])[O:39]1 |
|
