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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

obacunone

No data

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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

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Direct relations and traceable candidates grouped by relation type.

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