CPD-431
From metabolic_network
Revision as of 11:29, 18 January 2018 by Dyliss (Talk | contribs) (Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-7-DIMETHYLXANTHINE 3-7-DIMETHYLXANTHINE] == * smiles: ** CN2(C=NC1(=C(C(NC(N(C)1)=O)=O)2)) *...")
Contents
Metabolite 3-7-DIMETHYLXANTHINE
- smiles:
- CN2(C=NC1(=C(C(NC(N(C)1)=O)=O)2))
- inchi key:
- InChIKey=YAPQBXQYLJRXSA-UHFFFAOYSA-N
- common name:
- theobromine
- molecular weight:
- 180.166
- Synonym(s):
- 3,7-dimethylxanthine
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- DRUGBANK : DB01412
- PUBCHEM:
- HMDB : HMDB02825
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- METABOLIGHTS : MTBLC28946
