Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

(s)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-tetradecanone

C21H34O4

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 12

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: (s)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-tetradecanone
Molecular Formula: C21H34O4
Molecular Weight: No data
Canonical SMILES: CCCCCCCCCC(CC(=O)CCC1=CC(=C(C=C1)O)OC)O
Isomeric SMILES: CCCCCCCCC[C@@H](CC(=O)CCC1=CC(=C(C=C1)O)OC)O
InChI: InChI=1S/C21H34O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,18,22,24H,3-11,13,16H2,1-2H3/t18-/m0/s1
Oral Bioavailability: 19.138
Drug Likeness: 0.473
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.

Source Herbs Active Targets

Active Targets

ingredient target8 Targets

Graph More Targets

01

adrenoceptor alpha 1B

adrenoceptor alpha 1B

02

adrenoceptor beta 1

adrenoceptor beta 1

03

adrenoceptor beta 2

adrenoceptor beta 2

04

aldo-keto reductase family 1 member B

aldo-keto reductase family 1 member B

05

cholinergic receptor muscarinic 1

cholinergic receptor muscarinic 1

06

cytochrome P450 family 2 subfamily A member 6

cytochrome P450 family 2 subfamily A member 6

07

cytochrome P450 family 2 subfamily B member 6

cytochrome P450 family 2 subfamily B member 6

08

cytochrome P450 family 2 subfamily C member 19

cytochrome P450 family 2 subfamily C member 19