CHEBI:31668 - Hepronicate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Hepronicate
ChEBI ID CHEBI:31668
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C28H31N3O6
C28H31N3O6
Net Charge 0
Average Mass 505.563
Monoisotopic Mass 505.22129
InChI InChI=1S/C28H31N3O6/c1-2-3-4-5-12-28(19-35-25(32)22-9-6-13-29-16-22,20-36-26(33)23-10-7-14-30-17-23)21-37-27(34)24-11-8-15-31-18-24/h6-11,13-18H,2-5,12,19-21H2,1H3
InChIKey GUIBJJJLGSYNKE-UHFFFAOYSA-N
SMILES C(COC(=O)C=1C=CC=NC1)(COC(=O)C=2C=CC=NC2)(COC(=O)C=3C=CC=NC3)CCCCCC
ChEBI Ontology
Outgoing Hepronicate (CHEBI:31668) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
Hepronicate KEGG COMPOUND
megrin DrugCentral
Manual Xrefs Databases
1359 DrugCentral
D01882 KEGG DRUG
View more database links
Registry Number Type Source
7237-81-2 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017