2,8-Dihydroxy-3,4,7-trimethoxy-9,10-dihydrophenanthrene

Details

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Internal ID c9d3ab95-6582-42ad-b883-54e094f74cf4
Taxonomy Benzenoids > Phenanthrenes and derivatives > Hydrophenanthrenes
IUPAC Name 2,5,6-trimethoxy-9,10-dihydrophenanthrene-1,7-diol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C17H18O5/c1-20-13-7-6-10-11(15(13)19)5-4-9-8-12(18)16(21-2)17(22-3)14(9)10/h6-8,18-19H,4-5H2,1-3H3
InChI Key OHYOIWRALJDPTD-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C17H18O5
Molecular Weight 302.32 g/mol
Exact Mass 302.11542367 g/mol
Topological Polar Surface Area (TPSA) 68.20 Ų
XlogP 3.00

Synonyms

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SCHEMBL23203424
2,8-dihydroxy-3,4,7-trimethoxy-9,10-dihydrophenanthrene

2D Structure

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2D Structure of 2,8-Dihydroxy-3,4,7-trimethoxy-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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 98.32% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 98.20% 91.49%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 94.47% 96.09%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 91.55% 91.79%
CHEMBL2535 P11166 Glucose transporter 91.16% 98.75%
CHEMBL2056 P21728 Dopamine D1 receptor 91.14% 91.00%
CHEMBL2581 P07339 Cathepsin D 89.74% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.49% 86.33%
CHEMBL2002 P12268 Inosine-5'-monophosphate dehydrogenase 2 87.28% 98.21%
CHEMBL4208 P20618 Proteasome component C5 86.75% 90.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 86.23% 99.17%
CHEMBL217 P14416 Dopamine D2 receptor 85.62% 95.62%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 84.99% 95.56%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.66% 95.89%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 84.24% 94.00%
CHEMBL1163101 O75460 Serine/threonine-protein kinase/endoribonuclease IRE1 84.20% 98.11%
CHEMBL5747 Q92793 CREB-binding protein 82.40% 95.12%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 81.86% 89.62%
CHEMBL1913 P09619 Platelet-derived growth factor receptor beta 80.88% 95.70%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 80.64% 95.78%

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 24762425
NPASS NPC10314
ChEMBL CHEMBL254599
LOTUS LTS0231324
wikiData Q105192392