Caffeine

Basic Information

CAS ID: 58-08-2
Molecular Formula: C8H10N4O2
Molecular Weight: 194.0804 g/mol
Monoisotopic Mass: 194.2 g/mol
Class: Small Molecule
Natural Product: No
Other Names: CAFCIT | YEAST-VITE | THEINE | PEYONA | PRO-PLUS | METHYLTHEOBROMINE | NODOZ | CAFFEINE, CITRATED | Caffeine | Cafcit | CAFFEINE CITRATE | ZANTHINE | COFFEINE
Analysis: Drug repositioning mechanism analysis

N O N N N O

Compound Structure and Identifier

InChI: InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3 See All
InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N
Smiles: CN1C(=O)N(C)c2ncn(C)c2C1=O See All
Molfile: Download

Related Target

Related Fibrosis Property

Reference Record 1

PubMed ID 19221177 Target ID
Uniprot ID Name
Model vitro,mice Fibrosis Disease Peritoneal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Trial Record 1

ClinicalTrial ID NCT02929901 Disease Liver fibrosis
Phase Phase 2,Phase 3 Status Unknown
First Received October 11, 2016 Last Verified October 18, 2016
Sponsor National Nutrition and Food Technology Institute

Related Link

PubChem: 2519
ChEMBL: CHEMBL113