CHEBI:85991 - panobinostat lactate

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ChEBI Name panobinostat lactate
Definition A lactate salt having panobinostat(1+) as the counterion. A histone deacetylase inhibitor used in combination with bortezomib and dexamethasone for the treatment of multiple myeloma.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C24H29N3O5
Net Charge 0
Average Mass 439.50420
Monoisotopic Mass 439.21072
InChI InChI=1S/C21H23N3O2.C3H6O3/c1-15-18(19-4-2-3-5-20(19)23-15)12-13-22-14-17-8-6-16(7-9-17)10-11-21(25)24-26;1-2(4)3(5)6/h2-11,22-23,26H,12-14H2,1H3,(H,24,25);2,4H,1H3,(H,5,6)/b11-10+;
SMILES CC(O)C(O)=O.Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1
Roles Classification
Biological Role(s): EC (histone deacetylase) inhibitor
An EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor that interferes with the function of histone deacetylase (EC
Application(s): angiogenesis modulating agent
An agent that modulates the physiologic angiogenesis process. This is accomplished by endogenous angiogenic proteins and a variety of other chemicals and pharmaceutical agents.
antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing panobinostat lactate (CHEBI:85991) has part panobinostat(1+) (CHEBI:85992)
panobinostat lactate (CHEBI:85991) has role angiogenesis modulating agent (CHEBI:50926)
panobinostat lactate (CHEBI:85991) has role antineoplastic agent (CHEBI:35610)
panobinostat lactate (CHEBI:85991) has role EC (histone deacetylase) inhibitor (CHEBI:61115)
panobinostat lactate (CHEBI:85991) is a lactate salt (CHEBI:24997)
panobinostat lactate (CHEBI:85991) is a organoammonium salt (CHEBI:46850)
2-hydroxypropanoic acid—(2E)-N-hydroxy-3-[4-({[2-(2-methyl-1H-indol-3-yl)ethyl]amino}methyl)phenyl]prop-2-enamide (1/1)
N-({4-[(1E)-3-(hydroxyamino)-3-oxoprop-1-en-1-yl]phenyl}methyl)-2-(2-methyl-1H-indol-3-yl)ethan-1-aminium 2-hydroxypropanoate
Brand Name Source
Farydak ChEBI
Manual Xrefs Databases
Panobinostat Wikipedia
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Registry Numbers Types Sources
15615390 Reaxys Registry Number Reaxys
960055-56-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
25837990 PubMed citation Europe PMC
25859117 PubMed citation Europe PMC
25939707 PubMed citation Europe PMC
25987820 PubMed citation Europe PMC
Last Modified
10 June 2015