Skip to main content
Ingredients

obacunone

No data

Entity Type
Ingredients
Relation Groups
5
Relation Preview
38

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
obacunone
Molecular Formula
No data
Molecular Weight
462.550
Canonical SMILES
C1(=O)C([H])=C([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])C([H])([H])[C@]2(C([H])([H])[H])[C@@]34[C@]([H])(O3)C(=O)O[C@@]2([H])c5c([H])c([H])oc5[H])[C@@]4(C([H])([H])[H])C(=O)C6([H])[H])[C@@]6([H] )C(C([H])([H])[H])(C([H])([H])[H])O1
Isomeric SMILES
No data
InChI
No data
Oral Bioavailability
81.579
Drug Likeness
No data
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 ingredient8 Herbs
01
关黄柏
Guan Huang Bo / Phellodendri Amurensis Cortex; Cortex Phellodendri Amurensis
Guan Huang BoPhellodendri Amurensis Cortex; Cortex Phellodendri Amurensis
03
吴茱萸
Wu Zhu Yu / Euodiae Fructus; Fructus Evodiae
Wu Zhu YuEuodiae Fructus; Fructus Evodiae
06
枳实
Zhi Shi / Fructus Aurantii Immaturus; Aurantii Fructus Immaturus
Zhi ShiFructus Aurantii Immaturus; Aurantii Fructus Immaturus
08
橘白
Ju Bai / Pericarpium Citri Reticulatae
Ju BaiPericarpium Citri Reticulatae