PCIDB

KNApSAcK Metabolite C00001751

Metabolite

KNApSAcK Entry

id C00001751
Name Mitragynine
CAS RN 4098-40-2
Standard InChI InChI=1S/C23H30N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h6-8,13-14,16,19,24H,5,9-12H2,1-4H3/b17-13+/t14-,16+,19+/m1/s1
Standard InChI (Main Layer) InChI=1S/C23H30N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h6-8,13-14,16,19,24H,5,9-12H2,1-4H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 246

Link

ChEMBL

By standard InChI CHEMBL299031
By standard InChI Main Layer CHEMBL58496 CHEMBL299031 CHEMBL107364

KEGG

By LinkDB C09226

CTD

By CAS RN C001801

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Mitragyna speciosa 170351 Rubiaceae asterids Viridiplantae

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P41143 Delta-type opioid receptor Opioid receptor CHEMBL299031 CHEMBL756037 (1) CHEMBL857861 (1)
0 / 0

CTD interaction (7)

compound gene gene name gene description interaction interaction type form reference
pmid
C001801 1544 CYP1A2
CP12
P3-450
P450(PA)
cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) mitragynine results in increased activity of CYP1A2 protein increases activity
protein 23274770
C001801 1544 CYP1A2
CP12
P3-450
P450(PA)
cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) mitragynine results in increased expression of CYP1A2 mRNA increases expression
mRNA 23274770
C001801 1544 CYP1A2
CP12
P3-450
P450(PA)
cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) mitragynine results in increased expression of CYP1A2 protein increases expression
protein 23274770
C001801 1565 CYP2D6
CPD6
CYP2D
CYP2D7AP
CYP2D7BP
CYP2D7P2
CYP2D8P2
CYP2DL1
CYPIID6
P450-DB1
P450C2D
P450DB1
cytochrome P450, family 2, subfamily D, polypeptide 6 (EC:1.14.14.1) mitragynine results in increased expression of CYP2D6 protein increases expression
protein 23274770
C001801 1576 CYP3A4
CP33
CP34
CYP3A
CYP3A3
CYPIIIA3
CYPIIIA4
HLP
NF-25
P450C3
P450PCN1
cytochrome P450, family 3, subfamily A, polypeptide 4 (EC:1.14.13.67 1.14.13.97 1.14.13.32 1.14.13.157) mitragynine results in increased activity of CYP3A4 protein increases activity
protein 23274770
C001801 1576 CYP3A4
CP33
CP34
CYP3A
CYP3A3
CYPIIIA3
CYPIIIA4
HLP
NF-25
P450C3
P450PCN1
cytochrome P450, family 3, subfamily A, polypeptide 4 (EC:1.14.13.67 1.14.13.97 1.14.13.32 1.14.13.157) mitragynine results in increased expression of CYP3A4 mRNA increases expression
mRNA 23274770
C001801 1576 CYP3A4
CP33
CP34
CYP3A
CYP3A3
CYPIIIA3
CYPIIIA4
HLP
NF-25
P450C3
P450PCN1
cytochrome P450, family 3, subfamily A, polypeptide 4 (EC:1.14.13.67 1.14.13.97 1.14.13.32 1.14.13.157) mitragynine results in increased expression of CYP3A4 protein increases expression
protein 23274770