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Ingredients

Picein

C14H18O7

Entity Type
Ingredients
Relation Groups
4
Relation Preview
29

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Picein
Molecular Formula
C14H18O7
Molecular Weight
No data
Canonical SMILES
CC(=O)C1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O
Isomeric SMILES
CC(=O)C1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChI
InChI=1S/C14H18O7/c1-7(16)8-2-4-9(5-3-8)20-14-13(19)12(18)11(17)10(6-15)21-14/h2-5,10-15,17-19H,6H2,1H3/t10-,11-,12+,13-,14-/m1/s1
Oral Bioavailability
9.477
Drug Likeness
0.530
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

Direct relations and traceable candidates grouped by relation type.

Active Targets

ingredient target8 Targets
03
AKR1C3
aldo-keto reductase family 1 member C3
aldo-keto reductase family 1 member C3
04
ALDH2
aldehyde dehydrogenase 2 family member
aldehyde dehydrogenase 2 family member