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loading...| Preferred Name |
Hepronicate |
| Synonyms |
Hepronicate megrin |
| ID |
http://purl.obolibrary.org/obo/CHEBI_31668 |
| charge |
0 |
| database_cross_reference |
KEGG:D01882 CAS:7237-81-2 Drug_Central:1359 |
| formula |
C28H31N3O6 |
| has_exact_synonym |
Hepronicate |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
megrin |
| id |
CHEBI:31668 |
| in_subset | |
| 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 |
| label |
Hepronicate |
| mass |
505.563 |
| monoisotopicmass |
505.22129 |
| notation |
CHEBI:31668 |
| prefLabel |
Hepronicate |
| smiles |
C(COC(=O)C=1C=CC=NC1)(COC(=O)C=2C=CC=NC2)(COC(=O)C=3C=CC=NC3)CCCCCC |
| treeView | |
| subClassOf |