Corydine

Details

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Internal ID b11bfb02-2363-4035-b3d8-4ce4fa541f93
Taxonomy Alkaloids and derivatives > Aporphines
IUPAC Name (6aS)-2,10,11-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol
SMILES (Canonical) CN1CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)OC)O)OC
SMILES (Isomeric) CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)OC)O)OC
InChI InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)19(22)18-16(12)13(21)9-11-5-6-14(23-2)20(25-4)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1
InChI Key IDQUPXZJURZAGF-ZDUSSCGKSA-N
Popularity 7 references in papers

Physical and Chemical Properties

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Molecular Formula C20H23NO4
Molecular Weight 341.40 g/mol
Exact Mass 341.16270821 g/mol
Topological Polar Surface Area (TPSA) 51.20 Ų
XlogP 2.60

Synonyms

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476-69-7
(+)-Corydine
Glaucentrine
Glaucentrin
d-Corydine
(S)-(+)-Corydine
O(sup 11)-Methylcorytuberine
BRN 0095568
UNII-1O1D15OP5R
1O1D15OP5R
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Corydine

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 99.05% 96.09%
CHEMBL217 P14416 Dopamine D2 receptor 98.34% 95.62%
CHEMBL2056 P21728 Dopamine D1 receptor 94.90% 91.00%
CHEMBL1951 P21397 Monoamine oxidase A 94.89% 91.49%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.46% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.03% 95.56%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 89.55% 89.62%
CHEMBL4208 P20618 Proteasome component C5 89.29% 90.00%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 88.85% 93.40%
CHEMBL5608 Q16288 NT-3 growth factor receptor 88.67% 95.89%
CHEMBL2581 P07339 Cathepsin D 87.88% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 87.43% 86.33%
CHEMBL3438 Q05513 Protein kinase C zeta 87.40% 88.48%
CHEMBL4261 Q16665 Hypoxia-inducible factor 1 alpha 86.55% 85.14%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 85.20% 94.00%
CHEMBL3192 Q9BY41 Histone deacetylase 8 85.03% 93.99%
CHEMBL2069156 Q14145 Kelch-like ECH-associated protein 1 84.84% 82.38%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 83.89% 95.89%
CHEMBL5469 Q14289 Protein tyrosine kinase 2 beta 83.86% 91.03%
CHEMBL2041 P07949 Tyrosine-protein kinase receptor RET 83.76% 91.79%
CHEMBL5339 Q5NUL3 G-protein coupled receptor 120 83.39% 95.78%
CHEMBL2535 P11166 Glucose transporter 81.71% 98.75%
CHEMBL241 Q14432 Phosphodiesterase 3A 80.17% 92.94%

Cross-Links

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PubChem 10153
NPASS NPC117188
ChEMBL CHEMBL489524
LOTUS LTS0063811
wikiData Q27252668