CHEBI:114193 - (3S)-6,7-dimethoxy-3-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-isobenzofuran-1-one

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ChEBI Name (3S)-6,7-dimethoxy-3-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-isobenzofuran-1-one
ChEBI ID CHEBI:114193
Stars This entity has been manually annotated by a third party.
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Formula C21H21NO6
Net Charge 0
Average Mass 383.395
Monoisotopic Mass 383.13689
InChI InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m0/s1
InChIKey JZUTXVTYJDCMDU-OALUTQOASA-N
SMILES CN1CCC2=CC3=C(C=C2[C@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3
ChEBI Ontology
Outgoing (3S)-6,7-dimethoxy-3-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-isobenzofuran-1-one (CHEBI:114193) is a isoquinolines (CHEBI:24922)
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