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Ingredients

Tanshinone i

C18H12O3

Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Tanshinone i
Molecular Formula
C18H12O3
Molecular Weight
No data
Canonical SMILES
CC1=C2C=CC3=C(C2=CC=C1)C(=O)C(=O)C4=C3OC=C4C
Isomeric SMILES
CC1=C2C=CC3=C(C2=CC=C1)C(=O)C(=O)C4=C3OC=C4C
InChI
InChI=1S/C18H12O3/c1-9-4-3-5-12-11(9)6-7-13-15(12)17(20)16(19)14-10(2)8-21-18(13)14/h3-8H,1-2H3
Oral Bioavailability
29.265
Drug Likeness
0.581
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
02
ACADVL
acyl-CoA dehydrogenase very long chain
acyl-CoA dehydrogenase very long chain
03
ACHE
acetylcholinesterase (Cartwright blood group)
acetylcholinesterase (Cartwright blood group)
05
ACSL1
acyl-CoA synthetase long chain family member 1
acyl-CoA synthetase long chain family member 1
07
ALDH1A3
aldehyde dehydrogenase 1 family member A3
aldehyde dehydrogenase 1 family member A3
08
ALDH3A2
aldehyde dehydrogenase 3 family member A2
aldehyde dehydrogenase 3 family member A2