| Properties | Image |
|---|
| MNX_ID | MNXM1183658 |
 |
| reference | envipathM:...4939da196d9c |
| formula | C12H15Cl3O5 |
| global charge | 0 |
| mol weight | 345.606 |
| InChIKey | HGLAODSZIRPDES-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H15Cl3O5/c13-11-5(16)1-4(12(11,14)15)10(20)3-2-9(19,8(10)11)7(18)6(3)17/h3-8,16-20H,1-2H2 |
| SMILES | OC1C(O)C2(O)CC1C1(O)C3CC(O)C(Cl)(C21)C3(Cl)Cl |
MNX internals
| InChI (mnx) | InChI=1/C12H15Cl3O5/c13-11-5(16)1-4(12(11,14)15)10(20)3-2-9(19,8(10)11)7(18)6(3)17/h3-8,16-20H,1-2H2/t3?,4?,5?,6?,7?,8?,9?,10?,11? |
 |
| SMILES (mnx) | [CH2:1]1[CH:4]2[C:10]3([OH:20])[CH:3]4[CH2:2][C:9]([OH:19])([CH:7]([OH:18])[CH:6]4[OH:17])[CH:8]3[C:11]([Cl:13])([CH:5]1[OH:16])[C:12]2([Cl:14])[Cl:15] |
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