CHEBI:3396 - Carbidopa-levodopa

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Carbidopa-levodopa
ChEBI ID CHEBI:3396
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C10H14N2O4.C9H11NO4
Net Charge 0
Average Mass 423.418
Monoisotopic Mass 423.16416
InChI InChI=1S/C10H14N2O4.C9H11NO4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6;10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h2-4,12-14H,5,11H2,1H3,(H,15,16);1-2,4,6,11-12H,3,10H2,(H,13,14)/t;6-/m.0/s1
InChIKey IVTMXOXVAHXCHI-ZCMDIHMWSA-N
SMILES N[C@@H](Cc1ccc(O)c(O)c1)C(O)=O.CC(Cc1ccc(O)c(O)c1)(NN)C(O)=O
ChEBI Ontology
Outgoing Carbidopa-levodopa (CHEBI:3396) is a organic molecular entity (CHEBI:50860)
Synonym Source
Carbidopa-levodopa KEGG COMPOUND
Manual Xref Database
C06870 KEGG COMPOUND
View more database links
Registry Number Type Source
57308-51-7 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014