3,3,8-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol

Details

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Internal ID 1ee86c89-940a-416e-aa66-3f0297e895cb
Taxonomy Organoheterocyclic compounds > Indoles and derivatives > Carbazoles
IUPAC Name 3,3,8-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
SMILES (Canonical) CC1=CC2=C(C=C1O)NC3=C2C=CC4=C3C=CC(O4)(C)C
SMILES (Isomeric) CC1=CC2=C(C=C1O)NC3=C2C=CC4=C3C=CC(O4)(C)C
InChI InChI=1S/C18H17NO2/c1-10-8-13-11-4-5-16-12(6-7-18(2,3)21-16)17(11)19-14(13)9-15(10)20/h4-9,19-20H,1-3H3
InChI Key PIXPDQLZGFAGST-UHFFFAOYSA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C18H17NO2
Molecular Weight 279.30 g/mol
Exact Mass 279.125928785 g/mol
Topological Polar Surface Area (TPSA) 45.20 Ų
XlogP 4.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 3,3,8-trimethyl-11H-pyrano[3,2-a]carbazol-9-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 99.23% 91.11%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 97.29% 94.45%
CHEMBL1951 P21397 Monoamine oxidase A 97.15% 91.49%
CHEMBL2292 Q13627 Dual-specificity tyrosine-phosphorylation regulated kinase 1A 96.13% 93.24%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 93.90% 93.40%
CHEMBL1937 Q92769 Histone deacetylase 2 91.49% 94.75%
CHEMBL2581 P07339 Cathepsin D 89.97% 98.95%
CHEMBL1806 P11388 DNA topoisomerase II alpha 89.69% 89.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 88.71% 93.99%
CHEMBL4208 P20618 Proteasome component C5 86.49% 90.00%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 85.70% 99.15%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 84.35% 95.56%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 84.12% 96.09%
CHEMBL2288 Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 83.09% 91.71%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 82.95% 94.00%
CHEMBL4225 P49760 Dual specificity protein kinase CLK2 82.82% 80.96%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 82.82% 94.80%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 82.25% 91.79%
CHEMBL213 P08588 Beta-1 adrenergic receptor 81.62% 95.56%
CHEMBL4224 P49759 Dual specificty protein kinase CLK1 80.21% 85.30%

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.
Bergera euchrestifolia

Cross-Links

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PubChem 15060939
LOTUS LTS0050870
wikiData Q104398703