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Ingredients

1alpha,3,2',4'-tetrahydroxy-2'-o-beta-d-glucopyra-nosylchalcone

C30H44O4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
3

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
1alpha,3,2',4'-tetrahydroxy-2'-o-beta-d-glucopyra-nosylchalcone
Molecular Formula
C30H44O4
Molecular Weight
No data
Canonical SMILES
CCC1C(OC(=O)C1=C)CC(C)C2CCC3C2(CCCC3=CC=C4CC(C(C(C4=C)O)C)O)C
Isomeric SMILES
CCC1C(OC(=O)C1=C)CC(C)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C/C=C/4\CC(C(C(C4=C)O)C)O)C
InChI
InChI=1S/C30H44O4/c1-7-23-19(4)29(33)34-27(23)15-17(2)24-12-13-25-21(9-8-14-30(24,25)6)10-11-22-16-26(31)20(5)28(32)18(22)3/h10-11,17,20,23-28,31-32H,3-4,7-9,12-16H2,1-2,5-6H3/b21-10-,22-11+/t17?,20?,23?,24-,25+,26?,27?,28?,30-/m1/s1
Oral Bioavailability
No data
Drug Likeness
0.389
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

Direct relations and traceable candidates grouped by relation type.

Source Herbs

herb ingredient2 Herbs
01
防己
Fang Ji / Stephaniae Tetrandrae Radix; Radix Stephaniae Tetrandrae
Fang JiStephaniae Tetrandrae Radix; Radix Stephaniae Tetrandrae