01
- Entity Type
- Ingredients
- Relation Groups
- 5
- Relation Preview
- 22
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3-O-benzoyl-20-deoxyingenol
- Molecular Formula
- No data
- Molecular Weight
- 436.590
- Canonical SMILES
- C1(C([H])([H])[H])=C([H])[C@]2(C(=O)[C@]([H])([C@]([H])(C3(C([H])([H])[H])C([H])([H])[H])[C@@]3([H])C([H])([H])[C@@]2([H])C([H])([H])[H])C([H])=C(C([H])([H])[H])[C@@]4([H])O[H])[C@@]4(O[H])[C@@]1([H]) OC(=O)c(c([H])c([H])c5[H])c([H])c5[H]
- Isomeric SMILES
- No data
- InChI
- No data
- Oral Bioavailability
- 12.273
- 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
- 102170523|121231388
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.
Related Syndromes
ingredient syndrome4 Syndromes