2,4,7-Trimethoxyphenanthren-3-ol

Details

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Internal ID aa505a1c-7fc0-4a84-96bf-ffb141c56f2f
Taxonomy Benzenoids > Phenanthrenes and derivatives > Phenanthrols
IUPAC Name 2,4,7-trimethoxyphenanthren-3-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C17H16O4/c1-19-12-6-7-13-10(8-12)4-5-11-9-14(20-2)16(18)17(21-3)15(11)13/h4-9,18H,1-3H3
InChI Key PPSSKXJCNJHWMI-UHFFFAOYSA-N
Popularity 4 references in papers

Physical and Chemical Properties

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Molecular Formula C17H16O4
Molecular Weight 284.31 g/mol
Exact Mass 284.10485899 g/mol
Topological Polar Surface Area (TPSA) 47.90 Ų
XlogP 4.00

Synonyms

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CHEMBL252356
SCHEMBL28864523

2D Structure

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2D Structure of 2,4,7-Trimethoxyphenanthren-3-ol

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 98.95% 91.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 92.60% 94.00%
CHEMBL1951 P21397 Monoamine oxidase A 90.45% 91.49%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 90.30% 99.15%
CHEMBL4208 P20618 Proteasome component C5 88.75% 90.00%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 88.75% 95.56%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 88.16% 96.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 86.73% 86.33%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.45% 99.17%
CHEMBL2373 P21730 C5a anaphylatoxin chemotactic receptor 85.44% 92.62%
CHEMBL2535 P11166 Glucose transporter 85.21% 98.75%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 84.98% 94.45%
CHEMBL215 P09917 Arachidonate 5-lipoxygenase 84.77% 92.68%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 84.01% 89.62%
CHEMBL2085 P14174 Macrophage migration inhibitory factor 83.41% 80.78%
CHEMBL1907 P15144 Aminopeptidase N 82.91% 93.31%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 82.86% 96.09%
CHEMBL3864 Q06124 Protein-tyrosine phosphatase 2C 80.16% 94.42%

Plants that contains it

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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.
Dendrobium nobile

Cross-Links

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PubChem 44445442
NPASS NPC243996
ChEMBL CHEMBL252356
LOTUS LTS0151538
wikiData Q105213029