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Ingredients

Graveoline

C17H13NO3

Entity Type
Ingredients
Relation Groups
2
Relation Preview
12

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Graveoline
Molecular Formula
C17H13NO3
Molecular Weight
No data
Canonical SMILES
CN1C2=CC=CC=C2C(=O)C=C1C3=CC4=C(C=C3)OCO4
Isomeric SMILES
CN1C2=CC=CC=C2C(=O)C=C1C3=CC4=C(C=C3)OCO4
InChI
InChI=1S/C17H13NO3/c1-18-13-5-3-2-4-12(13)15(19)9-14(18)11-6-7-16-17(8-11)21-10-20-16/h2-9H,10H2,1H3
Oral Bioavailability
No data
Drug Likeness
0.687
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
ALDH1A1
aldehyde dehydrogenase 1 family member A1
aldehyde dehydrogenase 1 family member A1
02
CYP1A2
cytochrome P450 family 1 subfamily A member 2
cytochrome P450 family 1 subfamily A member 2
03
CYP2C19
cytochrome P450 family 2 subfamily C member 19
cytochrome P450 family 2 subfamily C member 19
04
CYP2D6
cytochrome P450 family 2 subfamily D member 6
cytochrome P450 family 2 subfamily D member 6
05
CYP3A4
cytochrome P450 family 3 subfamily A member 4
cytochrome P450 family 3 subfamily A member 4
07
HIF1A
hypoxia inducible factor 1 subunit alpha
hypoxia inducible factor 1 subunit alpha
08
HPGD
15-hydroxyprostaglandin dehydrogenase
15-hydroxyprostaglandin dehydrogenase