2-Hydroxy4,7-dimethoxy-9,10-dihydrophenanthrene

Details

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Internal ID d47ff13e-2aed-4b99-8ec9-59b77fc6b935
Taxonomy Benzenoids > Phenanthrenes and derivatives > Hydrophenanthrenes
IUPAC Name 4,7-dimethoxy-9,10-dihydrophenanthren-2-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C16H16O3/c1-18-13-5-6-14-10(8-13)3-4-11-7-12(17)9-15(19-2)16(11)14/h5-9,17H,3-4H2,1-2H3
InChI Key HWILQAUQOIOQMW-UHFFFAOYSA-N
Popularity 5 references in papers

Physical and Chemical Properties

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Molecular Formula C16H16O3
Molecular Weight 256.30 g/mol
Exact Mass 256.109944368 g/mol
Topological Polar Surface Area (TPSA) 38.70 Ų
XlogP 3.40

Synonyms

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2-Hydroxy4,7-dimethoxy-9,10-dihydrophenanthrene
2-Phenanthrenol, 9,10-dihydro-4,7-dimethoxy-
2-hydroxy-4,7-dimethoxy-9,10-dihydrophenanthrene
CHEMBL254600
orb1941388
SCHEMBL23203411
2-hydroxy-4,7-dimethoxyphenanthrene
HY-N10882
DA-60138
CS-0637316

2D Structure

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2D Structure of 2-Hydroxy4,7-dimethoxy-9,10-dihydrophenanthrene

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
CHEMBL1951 P21397 Monoamine oxidase A 98.35% 91.49%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 97.86% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 94.97% 95.56%
CHEMBL4208 P20618 Proteasome component C5 94.83% 90.00%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.64% 96.09%
CHEMBL242 Q92731 Estrogen receptor beta 92.69% 98.35%
CHEMBL1293249 Q13887 Kruppel-like factor 5 90.69% 86.33%
CHEMBL2581 P07339 Cathepsin D 90.16% 98.95%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 89.68% 91.79%
CHEMBL2056 P21728 Dopamine D1 receptor 89.34% 91.00%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 86.90% 94.00%
CHEMBL1907 P15144 Aminopeptidase N 86.72% 93.31%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.36% 99.17%
CHEMBL5608 Q16288 NT-3 growth factor receptor 85.19% 95.89%
CHEMBL2535 P11166 Glucose transporter 85.03% 98.75%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 84.00% 95.89%
CHEMBL226 P30542 Adenosine A1 receptor 81.75% 95.93%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 81.11% 99.15%
CHEMBL241 Q14432 Phosphodiesterase 3A 80.08% 92.94%

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 24762426
NPASS NPC170485
ChEMBL CHEMBL254600
LOTUS LTS0263105
wikiData Q105034668