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Ingredients

(5r)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one

C21H34O4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
4

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(5r)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)tetradecan-3-one
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-/m1/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

herb ingredient1 Herbs
01
半夏
Ban Xia / Pinelliae Rhizoma; Rhizoma Pinelliae
Ban XiaPinelliae Rhizoma; Rhizoma Pinelliae