01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Sophojaponicin
- Molecular Formula
- C22H22O10
- Molecular Weight
- No data
- Canonical SMILES
- C1C2C(C3=C(O1)C=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC5=CC6=C(C=C25)OCO6
- Isomeric SMILES
- C1[C@H]2[C@@H](C3=C(O1)C=C(C=C3)O[C@H]4C([C@H]([C@@H](C(O4)CO)O)O)O)OC5=CC6=C(C=C25)OCO6
- InChI
- InChI=1S/C22H22O10/c23-6-17-18(24)19(25)20(26)22(32-17)30-9-1-2-10-13(3-9)27-7-12-11-4-15-16(29-8-28-15)5-14(11)31-21(10)12/h1-5,12,17-26H,6-8H2/t12-,17?,18-,19+,20?,21-,22-/m1/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.518
- 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
Related Entities
Direct relations and traceable candidates grouped by relation type.
Active Targets
ingredient target8 Targets
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