| Properties | Image |
|---|
| MNX_ID | MNXM1185300 |
 |
| reference | envipathM:...f20d40a19653 |
| formula | C14H19O13 |
| global charge | -1 |
| mol weight | 395.293 |
| InChIKey | SUQROYBONSIEJV-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H20O13/c15-2-4(16)1-5(7(17)10(20)12(22)23)13(24)26-3-6-8(18)9(19)11(21)14(25)27-6/h2,4-8,10-11,14,16-18,20-21,25H,1,3H2,(H,22,23)/p-1 |
| SMILES | O=CC(O)CC(C(=O)OCC1OC(O)C(O)C(=O)C1O)C(O)C(O)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C14H20O13/c15-2-4(16)1-5(7(17)10(20)12(22)23)13(24)26-3-6-8(18)9(19)11(21)14(25)27-6/h2,4-8,10-11,14,16-18,20-21,25H,1,3H2,(H,22,23)/t4?,5?,6?,7?,8?,10?,11?,14? |
 |
| SMILES (mnx) | [CH2:1]([CH:4]([CH:2]=[O:15])[OH:16])[CH:5]([CH:7]([CH:10]([C:12](=[O:22])[OH:23])[OH:20])[OH:17])[C:13](=[O:24])[O:26][CH2:3][CH:6]1[CH:8]([OH:18])[C:9](=[O:19])[CH:11]([OH:21])[CH:14]([OH:25])[O:27]1 |
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