CHEBI:9019 - Samidin

ChEBI IDCHEBI:9019
ChEBI NameSamidin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H22O7
Net Charge0
Average Mass386.400
Monoisotopic Mass386.13655
SMILESCC(=O)O[C@@H]1c2c(ccc3ccc(=O)oc23)OC(C)(C)[C@@H]1OC(=O)C=C(C)C
InChIInChI=1S/C21H22O7/c1-11(2)10-16(24)27-20-19(25-12(3)22)17-14(28-21(20,4)5)8-6-13-7-9-15(23)26-18(13)17/h6-10,19-20H,1-5H3/t19-,20-/m1/s1
InChIKeyFNVCLGWRMXTDSM-WOJBJXKFSA-N
ChEBI Ontology
Outgoing Relation(s)
Samidin (CHEBI:9019) is a coumarins (CHEBI:23403)
Synonym  Source
SamidinKEGG COMPOUND
Manual XrefsDatabases
C09310KEGG COMPOUND
C00002497KNApSAcK
Registry NumbersSources
CAS:477-33-8KEGG COMPOUND