Skip to main content
Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

(3r,5r)-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane-3,5-diol

C21H28O6

View Knowledge GraphBack to List
Entity Type
Ingredients
Relation Groups
2
Relation Preview
10

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(3r,5r)-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane-3,5-diol
Molecular Formula
C21H28O6
Molecular Weight
No data
Canonical SMILES
COC1=C(C=CC(=C1)CCC(CC(CCC2=CC(=C(C=C2)O)OC)O)O)O
Isomeric SMILES
COC1=C(C=CC(=C1)CC[C@H](C[C@@H](CCC2=CC(=C(C=C2)O)OC)O)O)O
InChI
InChI=1S/C21H28O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h5-6,9-12,16-17,22-25H,3-4,7-8,13H2,1-2H3/t16-,17-/m1/s1
Oral Bioavailability
5.505
Drug Likeness
0.509
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

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive Targets

Active Targets

ingredient target8 Targets
GraphMore Targets
07
MAPK14
mitogen-activated protein kinase 14
mitogen-activated protein kinase 14
DetailsGraph