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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL400092
CHEMBL400092
Compound Name LYCORINE
ChEMBL Synonyms GNF-Pf-4974
Max Phase 0
Trade Names
Molecular Formula C16H17NO4

Additional synonyms for CHEMBL400092 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@H]([C@@H]1O)[C@@H]23
Standard InChI InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12) ...
Download InChI
Standard InChI Key XGVJWXAYKUHDOO-DANNLKNASA-N

Structural Alerts

There are 1 structural alerts for CHEMBL400092. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL400092

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
287.3 287.1158 0.71 0 62.16 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
5 2 0 5 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 1.36 1.36 1 21 0.69

Compound Cross References

ChemSpider ChemSpider:XGVJWXAYKUHDOO-DANNLKNASA-N
PubChem SID: 26756786 SID: 472303
Wikipedia Lycorine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL400092



ACToR 476-28-8
BindingDB 50221066
ChEBI 6601
eMolecules 591348 30487840
EPA CompTox Dashboard DTXSID60197208
FDA SRS I9Q105R5BU
IBM Patent System 164545A97A52BC6D516F9A3593BE7023
KEGG Ligand C08532
Mcule MCULE-4471227410
MolPort MolPort-000-882-129
Nikkaji J5.973K
PDBe 3KD
PubChem 72378
PubChem: Thomson Pharma 15418602
SureChEMBL SCHEMBL626071
ZINC ZINC03881372

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/XGVJWXAYKUHDOO-DANNLKNASA-N spacer
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