| Properties | Image |
|---|
| MNX_ID | MNXM1196779 |
 |
| reference | envipathM:...4c98fd81e350 |
| formula | C12H13Cl4O5 |
| global charge | -1 |
| mol weight | 379.043 |
| InChIKey | UDGHPTSLPLEANE-UHFFFAOYSA-M |
| InChI | InChI=1S/C12H14Cl4O5/c13-10-1-2-11(14,12(10,15)16)6-5(10)4(17)3-9(6,21)7(18)8(19)20/h4-7,17-18,21H,1-3H2,(H,19,20)/p-1 |
| SMILES | O=C([O-])C(O)C1(O)CC(O)C2C1C1(Cl)CCC2(Cl)C1(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H14Cl4O5/c13-10-1-2-11(14,12(10,15)16)6-5(10)4(17)3-9(6,21)7(18)8(19)20/h4-7,17-18,21H,1-3H2,(H,19,20)/t4?,5?,6?,7?,9?,10?,11? |
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| SMILES (mnx) | [CH2:1]1[CH2:2][C:11]2([Cl:14])[CH:6]3[CH:5]([CH:4]([OH:17])[CH2:3][C:9]3([CH:7]([C:8](=[O:19])[OH:20])[OH:18])[OH:21])[C:10]1([Cl:13])[C:12]2([Cl:15])[Cl:16] |
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