Chem
J-GLOBAL ID:200907069633742740
Nikkaji number:J1.665.847B
1-Benzyl-2′-O,3′-O-isopropylideneinosine
1-ベンジル-2′-O,3′-O-イソプロピリデンイノシン
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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 H22 N4 O5
Molecular formula furigana:
C20-H22-N4-O5
Molecular weight:
398.419
InChI:
InChI=1S/C20H22N4O5/c1-20(2)28-15-13(9-25)27-19(16(15)29-20)24-11-21-14-17(24)22-10-23(18(14)26)8-12-6-4-3-5-7-12/h3-7,10-11,13,15-16,19,25H,8-9H2,1-2H3/t13-,15-,16-,19-/m1/s1
InChI key:
JQGMSUSVTNWYAN-NVQRDWNXSA-N
SMILES:
CC1(C)O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O1)n1cnc2c1ncn(Cc1ccccc1)c2=O
Systematic name (3):
1-ベンジル-2′-O,3′-O-イソプロピリデンイノシン
9-[(3aR,4R,6R,6aR)-6-(ヒドロキシメチル)-2,2-ジメチル-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]-1-ベンジル-6,9-ジヒドロ-1H-プリン-6-オン
9-[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-1-benzyl-6,9-dihydro-1H-purin-6-one
Other name (1):
1-Benzyl-2′-O,3′-O-isopropylideneinosine
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