Tolyporphin H

Details

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Internal ID acf74464-ed1b-4742-9178-720534c3a6d4
Taxonomy Organoheterocyclic compounds > Tetrapyrroles and derivatives
IUPAC Name (12-hydroxy-2,8,12,17-tetramethyl-3,13-dioxo-22,24-dihydroporphyrin-2-yl) acetate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C26H24N4O5/c1-12-7-16-9-22-26(5,35-14(3)31)24(33)19(30-22)8-15-6-13(2)18(27-15)11-21-25(4,34)23(32)20(29-21)10-17(12)28-16/h6-11,27-28,34H,1-5H3
InChI Key ACEUAOKAOJEZQZ-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C26H24N4O5
Molecular Weight 472.50 g/mol
Exact Mass 472.17466988 g/mol
Topological Polar Surface Area (TPSA) 138.00 Ų
XlogP 3.00

Synonyms

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(12-hydroxy-2,8,12,17-tetramethyl-3,13-dioxo-22,24-dihydroporphyrin-2-yl) acetate
RefChem:190343
17-hydroxy-2,7,13,17-tetramethyl-8,18-dioxo-7H,8H,17H,18H-porphyrin-7-yl acetate
CHEBI:205889
DTXSID501046197

2D Structure

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2D Structure of Tolyporphin H

3D Structure

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ADMET Properties (via admetSAR 2)

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

Targets

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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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 94.57% 91.11%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 94.34% 85.14%
CHEMBL2581 P07339 Cathepsin D 92.80% 98.95%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 90.10% 99.23%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 90.01% 94.45%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.64% 86.33%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 88.45% 94.00%
CHEMBL1937 Q92769 Histone deacetylase 2 84.82% 94.75%
CHEMBL230 P35354 Cyclooxygenase-2 84.26% 89.63%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 84.04% 96.21%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 84.01% 95.56%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 82.50% 93.03%
CHEMBL241 Q14432 Phosphodiesterase 3A 81.37% 92.94%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 80.27% 96.09%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 10254212
LOTUS LTS0079924
wikiData Q77514413