KNApSAcK Metabolite C00003440
Metabolite
KNApSAcK Entry
| id | C00003440 |
|---|---|
| Name | Ingenol 3,20-dibenzoate |
| CAS RN | 59086-90-7 |
| Standard InChI | InChI=1S/C34H36O7/c1-19-17-33-20(2)15-25-26(32(25,3)4)24(28(33)36)16-23(18-40-30(37)21-11-7-5-8-12-21)27(35)34(33,39)29(19)41-31(38)22-13-9-6-10-14-22/h5-14,16-17,20,24-27,29,35,39H,15,18H2,1-4H3/t20-,24+,25-,26+,27-,29+,33+,34+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C34H36O7/c1-19-17-33-20(2)15-25-26(32(25,3)4)24(28(33)36)16-23(18-40-30(37)21-11-7-5-8-12-21)27(35)34(33,39)29(19)41-31(38)22-13-9-6-10-14-22/h5-14,16-17,20,24-27,29,35,39H,15,18H2,1-4H3 |
Cluster
| Phytochemical cluster | No. 41 |
|---|---|
| KCF-S cluster | No. 3185 |
Link
ChEMBL
| By standard InChI | CHEMBL2165713 |
|---|---|
| By standard InChI Main Layer | CHEMBL347361 CHEMBL2165713 |
KEGG
| By LinkDB | C09113 |
|---|
CTD
| By CAS RN | C011875 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 2 |
Family
| family name | count |
|---|---|
| Euphorbiaceae | 2 |
List (2)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Croton tiglium L. | 497687 | Euphorbiaceae | rosids | Viridiplantae |
| Euphorbia escula | 3977 | Euphorbiaceae | rosids | Viridiplantae |
Human Protein / Gene in interaction
CTD interaction (2)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| C011875 | 5468 |
PPARG
CIMT1 GLM1 NR1C3 PPARG1 PPARG2 PPARgamma |
peroxisome proliferator-activated receptor gamma | ingenol dibenzoate results in increased activity of PPARG protein |
increases activity
|
protein |
15707588
|
| C011875 | 5587 |
PRKD1
PKC-MU PKCM PKD PRKCM |
protein kinase D1 (EC:2.7.11.13) | ingenol dibenzoate results in increased activity of PRKD1 protein |
increases activity
|
protein |
15707588
|