| Properties | Image |
|---|
| MNX_ID | MNXM1181871 |
 |
| reference | envipathM:...2eb3fe8cfb56 |
| formula | C12H20O7 |
| global charge | 0 |
| mol weight | 276.285 |
| InChIKey | RGGKNYILECNZRL-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H20O7/c1-5-11(16)7(13)4-10(18-5)19-12-6(2)17-9(15)3-8(12)14/h5-6,8-12,14-16H,3-4H2,1-2H3 |
| SMILES | CC1OC(OC2C(O)CC(O)OC2C)CC(=O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C12H20O7/c1-5-11(16)7(13)4-10(18-5)19-12-6(2)17-9(15)3-8(12)14/h5-6,8-12,14-16H,3-4H2,1-2H3/t5?,6?,8?,9?,10?,11?,12? |
 |
| SMILES (mnx) | [CH3:1][CH:5]1[CH:11]([OH:16])[C:7](=[O:13])[CH2:4][CH:10]([O:19][CH:12]2[CH:6]([CH3:2])[O:17][CH:9]([OH:15])[CH2:3][CH:8]2[OH:14])[O:18]1 |
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