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CHEBI:5462 - Glycobismine A

ChEBI IDCHEBI:5462
ChEBI NameGlycobismine A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC37H34N2O6
Net Charge0
Average Mass602.687
Monoisotopic Mass602.24169
SMILES[H]C1(c2c(O)c(CC=C(C)C)c3c(c2O)c(=O)c2ccccc2n3C)CC(C)(C)Oc2cc(O)c3c(=O)c4ccccc4nc3c21
InChIInChI=1S/C37H34N2O6/c1-18(2)14-15-21-32-30(34(42)20-11-7-9-13-24(20)39(32)5)36(44)28(35(21)43)22-17-37(3,4)45-26-16-25(40)29-31(27(22)26)38-23-12-8-6-10-19(23)33(29)41/h6-14,16,22,40,43-44H,15,17H2,1-5H3,(H,38,41)
InChIKeyMFWOOIANDMHWSJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Glycobismine A (CHEBI:5462) is a neoflavonoid (CHEBI:71971)
Synonym  Source
Glycobismine AKEGG COMPOUND
Manual XrefsDatabases
C10685KEGG COMPOUND
C00002165KNApSAcK
Registry NumbersSources
CAS:91147-20-5KEGG COMPOUND