Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

Deguelin

C23H22O6

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 13

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: Deguelin
Molecular Formula: C23H22O6
Molecular Weight: No data
Canonical SMILES: CC1(C=CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC)C
Isomeric SMILES: CC1(C=CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@H]4C3=O)OC)OC)C
InChI: InChI=1S/C23H22O6/c1-23(2)8-7-12-15(29-23)6-5-13-21(24)20-14-9-17(25-3)18(26-4)10-16(14)27-11-19(20)28-22(12)13/h5-10,19-20H,11H2,1-4H3/t19-,20+/m1/s1
Oral Bioavailability: No data
Drug Likeness: 0.767
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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Direct relations and traceable candidates grouped by relation type.

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