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Ingredients

Zinc02169908

C18H36O

Entity Type
Ingredients
Relation Groups
2
Relation Preview
9

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Zinc02169908
Molecular Formula
C18H36O
Molecular Weight
No data
Canonical SMILES
CC(C)CCCC(C)CCCC(C)CCCC(=O)C
Isomeric SMILES
C[C@H](CCC[C@H](C)CCCC(=O)C)CCCC(C)C
InChI
InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3/t16-,17-/m0/s1
Oral Bioavailability
23.302
Drug Likeness
0.423
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 target1 Targets
01
PTGS2
prostaglandin-endoperoxide synthase 2
prostaglandin-endoperoxide synthase 2