| Properties | Image |
| MNX_ID | MNXM106388 |
 |
| reference | keggD:D04835 |
| formula | C12H24MgO15 |
| global charge | 0 |
| mol weight | 432.614 |
| InChIKey | IAKLPCRFBAZVRW-XRDLMGPZSA-L |
| InChI | InChI=1S/2C6H12O7.Mg.H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;/h2*2-5,7-11H,1H2,(H,12,13);;1H2/q;;+2;/p-2/t2*2-,3-,4+,5-;;/m11../s1 |
| SMILES | O.O=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[Mg+2] |
MNX internals
| InChI (mnx) | InChI=1/2C6H12O7.Mg.H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;/h2*2-5,7-11H,1H2,(H,12,13);;1H2/q;;+2;/t2*2-,3-,4+,5-;;/m11../s1 |
 |
| SMILES (mnx) | [CH2:14]([C@H:15]([C@H:16]([C@@H:17]([C@H:18]([C:19](=[O:25])[OH:26])[OH:24])[OH:23])[OH:22])[OH:21])[OH:20].[CH2:1]([C@H:2]([C@H:3]([C@@H:4]([C@H:5]([C:6](=[O:12])[OH:13])[OH:11])[OH:10])[OH:9])[OH:8])[OH:7].[Mg+2:27].[OH2:28] |
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