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Ingredients

No-biletin

C21H22O8

Entity Type
Ingredients
Relation Groups
2
Relation Preview
9

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
No-biletin
Molecular Formula
C21H22O8
Molecular Weight
No data
Canonical SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC
Isomeric SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC
InChI
InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3
Oral Bioavailability
No data
Drug Likeness
0.594
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.

Active Targets

ingredient target8 Targets
01
ABCB1
ATP binding cassette subfamily B member 1
ATP binding cassette subfamily B member 1
03
ALDH1A1
aldehyde dehydrogenase 1 family member A1
aldehyde dehydrogenase 1 family member A1
05
BAX
BCL2 associated X, apoptosis regulator
BCL2 associated X, apoptosis regulator
08
CREB1
cAMP responsive element binding protein 1
cAMP responsive element binding protein 1