| Properties | Image |
|---|
| MNX_ID | MNXM1197601 |
 |
| reference | envipathM:...a2aec7594f50 |
| formula | C14H21O14 |
| global charge | -1 |
| mol weight | 413.308 |
| InChIKey | MLPDTBGBSXYEOR-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H22O14/c15-2-4(16)1-5-7(18)9(20)12(24)28-14(5)26-3-6(17)8(19)11(23)27-13(25)10(21)22/h2,4-9,12-14,16-20,24-25H,1,3H2,(H,21,22)/p-1 |
| SMILES | O=CC(O)CC1C(OCC(O)C(O)C(=O)OC(O)C(=O)[O-])OC(O)C(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C14H22O14/c15-2-4(16)1-5-7(18)9(20)12(24)28-14(5)26-3-6(17)8(19)11(23)27-13(25)10(21)22/h2,4-9,12-14,16-20,24-25H,1,3H2,(H,21,22)/t4?,5?,6?,7?,8?,9?,12?,13?,14? |
 |
| SMILES (mnx) | [CH2:1]([CH:4]([CH:2]=[O:15])[OH:16])[CH:5]1[CH:7]([OH:18])[CH:9]([OH:20])[CH:12]([OH:24])[O:28][CH:14]1[O:26][CH2:3][CH:6]([CH:8]([C:11](=[O:23])[O:27][CH:13]([C:10](=[O:21])[OH:22])[OH:25])[OH:19])[OH:17] |
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