| Properties | Image |
|---|
| MNX_ID | MNXM1172729 |
 |
| reference | envipathM:...3755bd4d6c8e |
| formula | C14H18O13 |
| global charge | 0 |
| mol weight | 394.285 |
| InChIKey | NUWFSGGLPWQCFI-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H18O13/c15-2-4(16)1-5-7(17)9(19)11(21)27-14(5)24-3-6-8(18)10(20)26-13(23)12(22)25-6/h2,5-7,9,11-14,17,19,21-23H,1,3H2 |
| SMILES | O=CC(=O)CC1C(OCC2OC(O)C(O)OC(=O)C2=O)OC(O)C(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C14H18O13/c15-2-4(16)1-5-7(17)9(19)11(21)27-14(5)24-3-6-8(18)10(20)26-13(23)12(22)25-6/h2,5-7,9,11-14,17,19,21-23H,1,3H2/t5?,6?,7?,9?,11?,12?,13?,14? |
 |
| SMILES (mnx) | [CH2:1]([C:4]([CH:2]=[O:15])=[O:16])[CH:5]1[CH:7]([OH:17])[CH:9]([OH:19])[CH:11]([OH:21])[O:27][CH:14]1[O:24][CH2:3][CH:6]1[C:8](=[O:18])[C:10](=[O:20])[O:26][CH:13]([OH:23])[CH:12]([OH:22])[O:25]1 |
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