01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Monascusone b
- Molecular Formula
- C17H18O5
- Molecular Weight
- No data
- Canonical SMILES
- CC=CC1=CC2=C(CO1)C(=O)C3(C(C2)C(C(=O)O3)C(=O)C)C
- Isomeric SMILES
- C/C=C/C1=CC2=C(CO1)C(=O)[C@]3([C@H](C2)[C@H](C(=O)O3)C(=O)C)C
- InChI
- InChI=1S/C17H18O5/c1-4-5-11-6-10-7-13-14(9(2)18)16(20)22-17(13,3)15(19)12(10)8-21-11/h4-6,13-14H,7-8H2,1-3H3/b5-4+/t13-,14-,17-/m1/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.575
- 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 ingredient1 Herbs