Demethoxyviridin

Details

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Internal ID 0baf6085-52f1-4ac6-805e-2d96ece51380
Taxonomy Benzenoids > Phenanthrenes and derivatives
IUPAC Name (1R,18R)-18-hydroxy-1-methyl-13-oxapentacyclo[10.6.1.02,10.05,9.015,19]nonadeca-2(10),3,5(9),12(19),14-pentaene-6,11,16-trione
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C19H14O5/c1-19-11-4-2-8-9(3-5-12(8)20)15(11)17(23)18-16(19)10(7-24-18)13(21)6-14(19)22/h2,4,7,14,22H,3,5-6H2,1H3/t14-,19+/m1/s1
InChI Key SWJBYJJNDIXFSA-KUHUBIRLSA-N
Popularity 21 references in papers

Physical and Chemical Properties

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Molecular Formula C19H14O5
Molecular Weight 322.30 g/mol
Exact Mass 322.08412354 g/mol
Topological Polar Surface Area (TPSA) 84.60 Ų
XlogP 1.70

Synonyms

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56660-21-0
(1r,11br)-1-hydroxy-11b-methyl-1,7,8,11b-tetrahydrocyclopenta[7,8]phenanthro[10,1-bc]furan-3,6,9(2h)-trione
CHEMBL549959
MEGxm0_000445
SCHEMBL12464244
ACon1_002366
DTXSID10972103
BDBM50296231
AKOS040748233
(1R,18R)-18-hydroxy-1-methyl-13-oxapentacyclo[10.6.1.02,10.05,9.015,19]nonadeca-2(10),3,5(9),12(19),14-pentaene-6,11,16-trione
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Demethoxyviridin

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 97.15% 91.11%
CHEMBL2581 P07339 Cathepsin D 96.71% 98.95%
CHEMBL1951 P21397 Monoamine oxidase A 95.09% 91.49%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 94.82% 95.56%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 90.43% 99.23%
CHEMBL4685 P14902 Indoleamine 2,3-dioxygenase 90.06% 96.38%
CHEMBL1994 P08235 Mineralocorticoid receptor 89.79% 100.00%
CHEMBL4040 P28482 MAP kinase ERK2 89.46% 83.82%
CHEMBL1806 P11388 DNA topoisomerase II alpha 89.42% 89.00%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 86.45% 94.45%
CHEMBL3351 Q13085 Acetyl-CoA carboxylase 1 86.30% 93.04%
CHEMBL1907 P15144 Aminopeptidase N 86.21% 93.31%
CHEMBL1293249 Q13887 Kruppel-like factor 5 86.18% 86.33%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 85.97% 90.71%
CHEMBL5608 Q16288 NT-3 growth factor receptor 85.76% 95.89%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.13% 96.09%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.78% 97.09%
CHEMBL2553 Q15418 Ribosomal protein S6 kinase alpha 1 81.39% 85.11%
CHEMBL2378 P30307 Dual specificity phosphatase Cdc25C 80.93% 96.67%

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 124337
LOTUS LTS0082719
wikiData Q82955817