cerulenin 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
578 17397-89-6

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • cerulenin
  • helicocerin
  • (+)-Cerulenin
An epoxydodecadienamide isolated from several species, including ACREMONIUM, Acrocylindrum, and Helicoceras. It inhibits the biosynthesis of several lipids by interfering with enzyme function.
  • Molecular weight: 223.27
  • Formula: C12H17NO3
  • CLOGP: 0.84
  • LIPINSKI: 0
  • HAC: 4
  • HDO: 1
  • TPSA: 72.69
  • ALOGS: -2.14
  • ROTB: 7

Drug dosage:

None

ADMET properties:

None

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
MeSH PA D000890 Anti-Infective Agents
MeSH PA D000935 Antifungal Agents
MeSH PA D000963 Antimetabolites
MeSH PA D054872 Fatty Acid Synthesis Inhibitors
MeSH PA D000960 Hypolipidemic Agents
CHEBI has role CHEBI:33281 antibiotics
CHEBI has role CHEBI:35221 antimetabolite
CHEBI has role CHEBI:35441 antiinfective agents
CHEBI has role CHEBI:35679 antilipemic drugs
CHEBI has role CHEBI:35718 antifungal agents
CHEBI has role CHEBI:50185 fatty acid synthesis inhibitors

Drug Use | Suggest Off label Use Form| |View source of the data|

None




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 13.21 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Fatty acid synthase Enzyme IC50 5.24 CHEMBL
Coagulation factor XIII A chain Enzyme IC50 5.40 CHEMBL
Pol polyprotein Enzyme IC50 5.60 CHEMBL

External reference:

IDSource
C0007839 UMLSCUI
CHEBI:171741 CHEBI
1X9 PDB_CHEM_ID
CHEMBL45627 ChEMBL_ID
DB01034 DRUGBANK_ID
D002569 MESH_DESCRIPTOR_UI
5282054 PUBCHEM_CID
MF286Y830Q UNII

Pharmaceutical products:

None