Saphenic acid

Details

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Internal ID 519e4e6d-07b1-4922-804d-6f2c6ad9c204
Taxonomy Organoheterocyclic compounds > Diazanaphthalenes > Benzodiazines > Quinoxalines > Phenazines and derivatives
IUPAC Name 6-(1-hydroxyethyl)phenazine-1-carboxylic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H12N2O3/c1-8(18)9-4-2-6-11-13(9)16-12-7-3-5-10(15(19)20)14(12)17-11/h2-8,18H,1H3,(H,19,20)
InChI Key OWDPOEGUZYTAJW-UHFFFAOYSA-N
Popularity 8 references in papers

Physical and Chemical Properties

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Molecular Formula C15H12N2O3
Molecular Weight 268.27 g/mol
Exact Mass 268.08479225 g/mol
Topological Polar Surface Area (TPSA) 83.30 Ų
XlogP 1.70

Synonyms

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6-(1-hydroxyethyl)phenazine-1-carboxylic acid
SCHEMBL16431284
CHEBI:29676
6-(1-hydroxyethyl) phenazine-1-carboxylic acid
Q27110222

2D Structure

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2D Structure of Saphenic acid

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
CHEMBL2581 P07339 Cathepsin D 96.42% 98.95%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 95.57% 85.14%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.27% 96.09%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 91.66% 99.23%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.60% 95.56%
CHEMBL3359 P21462 Formyl peptide receptor 1 91.48% 93.56%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 91.36% 81.11%
CHEMBL1293294 P51151 Ras-related protein Rab-9A 88.69% 87.67%
CHEMBL3401 O75469 Pregnane X receptor 87.57% 94.73%
CHEMBL1293249 Q13887 Kruppel-like factor 5 85.87% 86.33%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 84.49% 96.00%
CHEMBL3714130 P46095 G-protein coupled receptor 6 81.46% 97.36%
CHEMBL2535 P11166 Glucose transporter 81.27% 98.75%

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 443633
LOTUS LTS0063690
wikiData Q27110222