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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Quinic acid

C7H12O6

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
15

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Quinic acid
Molecular Formula
C7H12O6
Molecular Weight
No data
Canonical SMILES
C1C(C(C(CC1(C(=O)O)O)O)O)O
Isomeric SMILES
C1[C@H](C([C@@H](CC1(C(=O)O)O)O)O)O
InChI
InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5?,7?/m1/s1
Oral Bioavailability
55.924
Drug Likeness
0.318
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

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Direct relations and traceable candidates grouped by relation type.

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