| Phytochemical Name : Chelidonic acid |
| PCNDIDC0105 |
| Pubchem CID : 7431 |
| Molecular formula: C7H4O6 |
| Canonical SMILES : C1=C(OC(=CC1=O)C(=O)O)C(=O)O |
Synonymes : Chelidonic acid|99-32-1|4-OXO-4H-PYRAN-2,6-DICARBOXYLIC ACID|Jervaic acid|Jerva acid|Jervasic acid|Compound XI*|4-oxopyran-2,6-dicarboxylic acid|2,6-Dicarboxyl-4-pyrone|4H-Pyran-2,6-dicarboxylic acid, 4-oxo-|NSC 3979|Compound XI* (Cherry and Hageman)|4-Oxo-1,4-pyran-2,6-dicarboxylic acid|gamma-Pyrone-2,6-dicarboxylic acid|EINECS 202-749-0|UNII-T33U4W5K6O|BRN 0163607|C7H4O6|T33U4W5K6O|AI3-19253|NSC-3979|.gamma.-Pyrone-2,6-dicarboxylic acid|DTXSID30243928|NSC3979|5-18-08-00646 (Beilstein Handbook Reference)|chelidonsaure|MFCD00006577|4-Oxo-4H-pyran-2,6-dicarboxylicacid|Chelidonic acid, 98%|2,6-dicarboxy-4-pyrone|4H-Pyran-2, 4-oxo-|TimTec1_001281|SCHEMBL70569|CHELIDONIC ACID [MI]|4-Oxo-1,6-dicarboxylic acid|WLN: T6O DVJ BVQ FVQ|CHEBI:3586|Chelidonic acid (not validated)|y-Pyrone-2,6-dicarboxylic acid|PBAYDYUZOSNJGU-UHFFFAOYSA-|DTXCID60166419|HMS1537K05|HMS3886K12|4-oxo-pyran-2,6-dicarboxylic acid|AMY36600|C7-H4-O6|Chelidonic acid, analytical standard|4-oxo-4H-pyran-2,6-dicarboxylsyre|BBL037230|c0955|s5579|STK735535|AKOS003368630|CCG-266462|CS-W022229|DS-1596|HY-W041489|NCGC00174597-01|BP-12076|LS-127299|BB 0221249|FT-0623586|EN300-82795|A19372|C08476|AR-360/40172582|Q908483|Chelidonic acid, purum, anhydrous, >=98.0% (T)|Z1238543360|HLD |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : -0.010 |
| Log Po/w (XLOGP3) : -0.400 |
| Log Po/w (WLOGP) : 0.040 |
| Log Po/w (MLOGP) : -1.250 |
| Log Po/w (SILICOS-IT) : 0.170 |
| Consensus Log Po/w : -0.290 |