(2R)-5,7,8-trimethoxy-2-phenyl-2H-chromene

Details

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Internal ID 6134732a-9100-4acc-90e5-49bee9e121e4
Taxonomy Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 8-O-methylated flavonoids
IUPAC Name (2R)-5,7,8-trimethoxy-2-phenyl-2H-chromene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C18H18O4/c1-19-15-11-16(20-2)18(21-3)17-13(15)9-10-14(22-17)12-7-5-4-6-8-12/h4-11,14H,1-3H3/t14-/m1/s1
InChI Key AKGAHTGZXKRIMD-CQSZACIVSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C18H18O4
Molecular Weight 298.30 g/mol
Exact Mass 298.12050905 g/mol
Topological Polar Surface Area (TPSA) 36.90 Ų
XlogP 3.90

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2R)-5,7,8-trimethoxy-2-phenyl-2H-chromene

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
CHEMBL1293249 Q13887 Kruppel-like factor 5 92.25% 86.33%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.96% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.38% 95.56%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 91.28% 96.09%
CHEMBL4306 P22460 Voltage-gated potassium channel subunit Kv1.5 87.22% 94.03%
CHEMBL2535 P11166 Glucose transporter 82.75% 98.75%
CHEMBL4478 Q00975 Voltage-gated N-type calcium channel alpha-1B subunit 82.57% 97.14%

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 163026331
LOTUS LTS0039492
wikiData Q104913623