CHEBI:5351 - Gigantine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Gigantine
ChEBI ID CHEBI:5351
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C13H19NO3
Net Charge 0
Average Mass 237.295
Monoisotopic Mass 237.13649
InChI InChI=1S/C13H19NO3/c1-8-10-7-11(16-3)13(17-4)12(15)9(10)5-6-14(8)2/h7-8,15H,5-6H2,1-4H3/t8-/m0/s1
InChIKey HRJQUAXWKYISJC-QMMMGPOBSA-N
SMILES COc1cc2[C@H](C)N(C)CCc2c(O)c1OC
ChEBI Ontology
Outgoing Gigantine (CHEBI:5351) is a isoquinolines (CHEBI:24922)
Synonym Source
Gigantine KEGG COMPOUND
Manual Xrefs Databases
C00001860 KNApSAcK
C09445 KEGG COMPOUND
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Registry Number Type Source
32829-58-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014