01
Ingredients
2-methoxy-5-(e)-propenyl-phenol-beta-vicianoside
C21H30O11
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-methoxy-5-(e)-propenyl-phenol-beta-vicianoside
- Molecular Formula
- C21H30O11
- Molecular Weight
- No data
- Canonical SMILES
- CC=CC1=CC(=C(C=C1)OC)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
- Isomeric SMILES
- C/C=C/C1=CC(=C(C=C1)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@H](CO3)O)O)O)O)O)O
- InChI
- InChI=1S/C21H30O11/c1-3-4-10-5-6-12(28-2)13(7-10)31-21-19(27)17(25)16(24)14(32-21)9-30-20-18(26)15(23)11(22)8-29-20/h3-7,11,14-27H,8-9H2,1-2H3/b4-3+/t11-,14+,15-,16+,17-,18+,19+,20-,21+/m0/s1
- Oral Bioavailability
- 4.382
- Drug Likeness
- 0.278
- 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.
Source Herbs
herb ingredient2 Herbs
