CHEBI:31848 - Migrenin (TN)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Migrenin (TN)
ChEBI ID CHEBI:31848
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C25H30N6O10
C8H10N4O2.C11H12N2O.C6H8O7
Net Charge 0
Average Mass 574.541
Monoisotopic Mass 574.20234
InChI InChI=1S/C11H12N2O.C8H10N4O2.C6H8O7/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-8H,1-2H3;4H,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey XCRAFTGAMMSJLO-UHFFFAOYSA-N
SMILES C12=C(N(C(=O)N(C)C1=O)C)N=CN2C.N1(C=2C=CC=CC2)C(C=C(N1C)C)=O.C(CC(=O)O)(CC(=O)O)(C(=O)O)O
ChEBI Ontology
Outgoing Migrenin (TN) (CHEBI:31848) is a oxopurine (CHEBI:25810)
Synonyms Sources
1,5-dimethyl-2-phenyl-1,2-dihydropyrazol-3-one 1,3,7-trimethyl- KEGG COMPOUND
3,7-dihydropurine-2,6-dione 2-(carboxylatomethyl)-2-hydroxy-1, KEGG COMPOUND
4-dioxido-butane-1,4-dione KEGG COMPOUND
Migrenin (TN) KEGG COMPOUND
Manual Xref Database
D01706 KEGG DRUG
View more database links
Registry Number Type Source
8066-49-7 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017