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CHEBI:41737 - 2,3,6A,7,8,9-HEXAHYDRO-11H-[1,4]DIOXINO[2,3-G]PYRROLO[2,1-B][1,3]BENZOXAZIN-11-ONE

Default Structure
ChEBI IDCHEBI:41737
ChEBI Name2,3,6A,7,8,9-HEXAHYDRO-11H-[1,4]DIOXINO[2,3-G]PYRROLO[2,1-B][1,3]BENZOXAZIN-11-ONE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC13H13NO4
Net Charge0
Average Mass247.250
Monoisotopic Mass247.08446
SMILES[H]c1c2c(c([H])c3c1O[C@@]1([H])N(C3=O)C([H])([H])C([H])([H])C1([H])[H])OC([H])([H])C([H])([H])O2
InChIInChI=1S/C13H13NO4/c15-13-8-6-10-11(17-5-4-16-10)7-9(8)18-12-2-1-3-14(12)13/h6-7,12H,1-5H2/t12-/m1/s1
InChIKeyRQEPVMAYUINZRE-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
2,3,6A,7,8,9-HEXAHYDRO-11H-[1,4]DIOXINO[2,3-G]PYRROLO[2,1-B][1,3]BENZOXAZIN-11-ONE (CHEBI:41737) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2,3,6A,7,8,9-HEXAHYDRO-11H-[1,4]DIOXINO[2,3-G]PYRROLO[2,1-B][1,3]BENZOXAZIN-11-ONEPDBeChem
(6aR)-2,3,6a,7,8,9-hexahydro-11H-[1,4]dioxino[2,3-g]pyrrolo[2,1-b][1,3]benzoxazin-11-onePDBeChem
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