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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

3'-o-methylorobol

C16H12O6

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
15

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
3'-o-methylorobol
Molecular Formula
C16H12O6
Molecular Weight
No data
Canonical SMILES
COC1=C(C=CC(=C1)C2=COC3=CC(=CC(=C3C2=O)O)O)O
Isomeric SMILES
COC1=C(C=CC(=C1)C2=COC3=CC(=CC(=C3C2=O)O)O)O
InChI
InChI=1S/C16H12O6/c1-21-13-4-8(2-3-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
Oral Bioavailability
57.409
Drug Likeness
0.672
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
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