CHEBI:7032 - Musca-aurin-II

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Musca-aurin-II
ChEBI ID CHEBI:7032
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H16N2O10
Net Charge 0
Average Mass 420.328
Monoisotopic Mass 420.08049
InChI InChI=1S/C18H16N2O10/c21-14-7-9(6-13(30-14)18(28)29)5-10(15(22)23)19-2-1-8-3-11(16(24)25)20-12(4-8)17(26)27/h1-3,6-7,10,12,20H,4-5H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29)/b8-1-,19-2-/t10-,12-/m0/s1
InChIKey XWXLDVGDOHFZSG-XLBCKWNQSA-N
SMILES OC(=O)[C@H](Cc1cc(oc(=O)c1)C(O)=O)\N=C/C=C1C[C@H](NC(=C\1)C(O)=O)C(O)=O
ChEBI Ontology
Outgoing Musca-aurin-II (CHEBI:7032) has functional parent tetracarboxylic acid (CHEBI:35742)
Musca-aurin-II (CHEBI:7032) is a organooxygen compound (CHEBI:36963)
Synonym Source
Musca-aurin-II KEGG COMPOUND
Manual Xrefs Databases
C00001600 KNApSAcK
C08560 KEGG COMPOUND
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Registry Number Type Source
12624-17-8 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014