MetaADEDB 2.0 @ LMMD
Chlorogenic Acid
(CWVRJTMFETXNAD-JUHZACGLSA-N)
Structure
SMILES
O=C(O[C@@H]1C[C@@](O)(C[C@H]([C@H]1O)O)C(=O)O)/C=C/c1ccc(c(c1)O)O
Type(s)
Investigational
Molecular Formula:
C16H18O9
Molecular Weight:
354.309
Log P:
-0.6459
Hydrogen Bond Acceptor:
9
Hydrogen Bond Donor:
6
TPSA:
164.75
CAS Number(s):
327-97-9; 202650-88-2
Synonym(s)
1.
Chlorogenic Acid
2.
3-Caffeoylquinic Acid
3.
3 Caffeoylquinic Acid
4.
Acid, 3-Caffeoylquinic
5.
Acid, Chlorogenic
External Link(s)
MeSHD002726
PubChem Compound1794427
BindingDB50327036
ChEBI16112
95271
CHEMBLCHEMBL284616
DrugBankDB12029
KEGGcpd:C00852
Therapeutic Target DatabaseD02HCQ
ZINC2138728
Adverse Drug Event(s)
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