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Ingredients

(1r,2r)-bis((s)-2-ethylhexyl) cyclohexane-1,2-dicarboxylate

C24H44O4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
5

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(1r,2r)-bis((s)-2-ethylhexyl) cyclohexane-1,2-dicarboxylate
Molecular Formula
C24H44O4
Molecular Weight
No data
Canonical SMILES
CCCCC(CC)COC(=O)C1CCCCC1C(=O)OCC(CC)CCCC
Isomeric SMILES
CCCC[C@H](CC)COC(=O)[C@@H]1CCCC[C@H]1C(=O)OC[C@@H](CC)CCCC
InChI
InChI=1S/C24H44O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h19-22H,5-18H2,1-4H3/t19-,20-,21+,22+/m0/s1
Oral Bioavailability
29.380
Drug Likeness
0.323
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 target4 Targets
04
PTGS2
prostaglandin-endoperoxide synthase 2
prostaglandin-endoperoxide synthase 2