01
Ingredients
1,3,6,7-tetrahydroxy-8-(3-methyl-2-butenyl)-9h-xanthen-9-one
C18H16O6
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 2
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1,3,6,7-tetrahydroxy-8-(3-methyl-2-butenyl)-9h-xanthen-9-one
- Molecular Formula
- C18H16O6
- Molecular Weight
- No data
- Canonical SMILES
- CC(=CCC1=C(C(=CC2=C1C(=O)C3=C(C=C(C=C3O2)O)O)O)O)C
- Isomeric SMILES
- CC(=CCC1=C(C(=CC2=C1C(=O)C3=C(C=C(C=C3O2)O)O)O)O)C
- InChI
- InChI=1S/C18H16O6/c1-8(2)3-4-10-15-14(7-12(21)17(10)22)24-13-6-9(19)5-11(20)16(13)18(15)23/h3,5-7,19-22H,4H2,1-2H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.326
- 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