Chem
J-GLOBAL ID:200907097161013777
Nikkaji number:J1.238.136K
(5S)-5-[(5R)-5,6,7,8-Tetrahydro-6-methyl-1,3-dioxolo[4,5-g]isoquinoline-5-yl]furo[3,4-f]-1,3-benzodioxole-7(5H)-one
(5S)-5-[(5R)-5,6,7,8-テトラヒドロ-6-メチル-1,3-ジオキソロ[4,5-g]イソキノリン-5-イル]フロ[3,4-f]-1,3-ベンゾジオキソール-7(5H)-オン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H17 NO6
Molecular formula furigana:
C20-H17-N-O6
Molecular weight:
367.357
InChI:
InChI=1S/C20H17NO6/c1-21-3-2-10-4-14-15(24-8-23-14)5-11(10)18(21)19-12-6-16-17(26-9-25-16)7-13(12)20(22)27-19/h4-7,18-19H,2-3,8-9H2,1H3/t18-,19+/m1/s1
InChI key:
GDFCROCCWCFYQI-MOPGFXCFSA-N
SMILES:
CN1CCc2cc3OCOc3cc2[C@@H]1[C@H]1OC(=O)c2cc3OCOc3cc12
Systematic name (4):
(5S)-5-[(5R)-5,6,7,8-テトラヒドロ-6-メチル-1,3-ジオキソロ[4,5-g]イソキノリン-5-イル]フロ[3,4-f]-1,3-ベンゾジオキソール-7(5H)-オン
(7S)-7-[(5R)-5,6,7,8-テトラヒドロ-6-メチル-1,3-ジオキソロ[4,5-g]イソキノリン-5-イル]フロ[3,4-f]-1,3-ベンゾジオキソール-5(7H)-オン
(12S)-12-[(5R)-6-メチル-2H,5H,6H,7H,8H-[1,3]ジオキソロ[4,5-g]イソキノリン-5-イル]-4,6,11-トリオキサトリシクロ[7.3.0.03,7 ]ドデカ-1,3(7),8-トリエン-10-オン
(12S)-12-[(5R)-6-methyl-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-4,6,11-trioxatricyclo[7.3.0.03,7 ]dodeca-1,3(7),8-trien-10-one
Other name (2):
(5S)-5-[(5R)-5,6,7,8-Tetrahydro-6-methyl-1,3-dioxolo[4,5-g]isoquinoline-5-yl]furo[3,4-f]-1,3-benzodioxole-7(5H)-one
(7S)-7-[(5R)-5,6,7,8-Tetrahydro-6-methyl-1,3-dioxolo[4,5-g]isoquinoline-5-yl]furo[3,4-f]-1,3-benzodioxole-5(7H)-one
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