Tolyporphin J

Details

Top
Internal ID c7e3753f-1e12-45e5-a005-381bffaf8fe5
Taxonomy Organoheterocyclic compounds > Tetrapyrroles and derivatives
IUPAC Name 3,13-dihydroxy-3,7,13,18-tetramethyl-22,24-dihydroporphyrin-2,12-dione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C24H22N4O4/c1-11-6-14-8-19-23(3,31)21(29)17(27-19)7-13-5-12(2)16(25-13)10-20-24(4,32)22(30)18(28-20)9-15(11)26-14/h5-10,25-26,31-32H,1-4H3
InChI Key KDTTYUOOJRPMSG-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

Top
Molecular Formula C24H22N4O4
Molecular Weight 430.50 g/mol
Exact Mass 430.16410520 g/mol
Topological Polar Surface Area (TPSA) 132.00 Ų
XlogP 2.40

Synonyms

Top
213546-89-5
3,13-dihydroxy-3,7,13,18-tetramethyl-22,24-dihydroporphyrin-2,12-dione
DTXSID501046092
RefChem:190345
DTXCID901527969
8,18-dihydroxy-2,8,13,18-tetramethyl-7H,8H,17H,18H-porphyrin-7,17-dione
CHEMBL465401
SCHEMBL29884174
CHEBI:204895
8,18-Dihydroxy-2,8,13,18-tetramethyl-8,18-dihydro-21H,23H-porphine-7,17-dione
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

Top
2D Structure of Tolyporphin J

3D Structure

Top

ADMET Properties (via admetSAR 2)

Top
Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

Top

Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL230 P35354 Cyclooxygenase-2 96.15% 89.63%
CHEMBL2581 P07339 Cathepsin D 90.13% 98.95%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 89.87% 85.14%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.59% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.18% 95.56%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.52% 86.33%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 87.15% 99.23%
CHEMBL1937 Q92769 Histone deacetylase 2 87.06% 94.75%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 84.97% 96.21%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 84.61% 94.00%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 82.80% 93.03%
CHEMBL1907 P15144 Aminopeptidase N 82.01% 93.31%
CHEMBL2553 Q15418 Ribosomal protein S6 kinase alpha 1 81.78% 85.11%
CHEMBL3401 O75469 Pregnane X receptor 80.13% 94.73%

Plants that contains it

Top
Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

Top
PubChem 154165
LOTUS LTS0075428
wikiData Q77420797