| Properties | Image |
|---|
| MNX_ID | MNXM19838 |
 |
| reference | metacycM:CPD-13435 |
| formula | C18H28O14 |
| global charge | 0 |
| mol weight | 468.408 |
| InChIKey | WXKIUCLCGXDOFU-GXQORBKCSA-N |
| InChI | InChI=1S/C18H28O14/c19-1-4-7(20)14(32-17-10(23)13-8(21)5(30-17)2-26-13)11(24)18(29-4)31-12-6-3-27-15(12)9(22)16(25)28-6/h4-25H,1-3H2/t4-,5+,6+,7+,8-,9+,10+,11-,12-,13-,14+,15+,16-,17+,18+/m1/s1 |
| SMILES | OC[C@H]1O[C@@H](O[C@H]2[C@H]3OC[C@@H]2O[C@@H](O)[C@H]3O)[C@H](O)[C@@H](O[C@@H]2O[C@H]3CO[C@@H]([C@@H]2O)[C@@H]3O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C18H28O14/c19-1-4-7(20)14(32-17-10(23)13-8(21)5(30-17)2-26-13)11(24)18(29-4)31-12-6-3-27-15(12)9(22)16(25)28-6/h4-25H,1-3H2/t4-,5+,6+,7+,8-,9+,10+,11-,12-,13-,14+,15+,16-,17+,18+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]([C@@H:4]1[C@H:7]([OH:20])[C@H:14]([O:32][C@H:17]2[C@@H:10]([OH:23])[C@H:13]3[C@H:8]([OH:21])[C@H:5]([CH2:2][O:26]3)[O:30]2)[C@@H:11]([OH:24])[C@H:18]([O:31][C@@H:12]2[C@@H:6]3[CH2:3][O:27][C@H:15]2[C@H:9]([OH:22])[C@H:16]([OH:25])[O:28]3)[O:29]1)[OH:19] |
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