| Properties | Image |
|---|
| MNX_ID | MNXM1186491 |
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| reference | envipathM:...a1ced70b0a0d |
| formula | C14H21O14 |
| global charge | -1 |
| mol weight | 413.308 |
| InChIKey | MTVSGAQPIBEJJD-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H22O14/c15-2-4(16)1-14(26,10(21)9(20)11(22)23)13(25)27-3-5-6(17)7(18)8(19)12(24)28-5/h2,4-8,10,12-13,16-19,21,24-26H,1,3H2,(H,22,23)/p-1 |
| SMILES | O=CC(O)CC(O)(C(O)OCC1OC(O)C(O)C(O)C1O)C(O)C(=O)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C14H22O14/c15-2-4(16)1-14(26,10(21)9(20)11(22)23)13(25)27-3-5-6(17)7(18)8(19)12(24)28-5/h2,4-8,10,12-13,16-19,21,24-26H,1,3H2,(H,22,23)/t4?,5?,6?,7?,8?,10?,12?,13?,14? |
 |
| SMILES (mnx) | [CH2:1]([CH:4]([CH:2]=[O:15])[OH:16])[C:14]([CH:10]([C:9]([C:11]([OH:22])=[O:23])=[O:20])[OH:21])([CH:13]([OH:25])[O:27][CH2:3][CH:5]1[CH:6]([OH:17])[CH:7]([OH:18])[CH:8]([OH:19])[CH:12]([OH:24])[O:28]1)[OH:26] |
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