Chem
J-GLOBAL ID：200907002373308784
Nikkaji number：J2.349.794H
(3aβ,3bα,7aβ)-2-(4-Methoxybenzyl)-7α-(4-amidinophenyl)decahydro-2,6a-diaza-6aH-cyclopenta[a]pentalene-1,3-dione
(3aβ,3bα,7aβ)-2-(4-メトキシベンジル)-7α-(4-アミジノフェニル)デカヒドロ-2,6a-ジアザ-6aH-シクロペンタ[a]ペンタレン-1,3-ジオン
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
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
Molecular formula： C24H26N4O3
Molecular formula furigana： C24-H26-N4-O3
Molecular weight： 418.497
InChI：
InChI=1S/C24H26N4O3/c1-31-17-10-4-14(5-11-17)13-28-23(29)19-18-3-2-12-27(18)21(20(19)24(28)30)15-6-8-16(9-7-15)22(25)26/h4-11,18-21H,2-3,12-13H2,1H3,(H3,25,26)/t18-,19-,20-,21-/m1/s1
InChI key：
YVWASZWJNWYVJS-XRXFAXGQSA-N
SMILES：
COc1ccc(CN2C(=O)[C@@H]3[C@H]4CCCN4[C@@H]([C@@H]3C2=O)c2ccc(cc2)C(=N)N)cc1
Systematic name (3)：
- (3aβ,3bα,7aβ)-2-(4-メトキシベンジル)-7α-(4-アミジノフェニル)デカヒドロ-2,6a-ジアザ-6aH-シクロペンタ[a]ペンタレン-1,3-ジオン
- 4-[(3aR,4S,8aR,8bS)-2-[(4-メトキシフェニル)メチル]-1,3-ジオキソ-デカヒドロピロロ[3,4-a]ピロリジン-4-イル]ベンゼン-1-カルボキシミドアミド
- 4-[(3aR,4S,8aR,8bS)-2-[(4-methoxyphenyl)methyl]-1,3-dioxo-decahydropyrrolo[3,4-a]pyrrolizin-4-yl]benzene-1-carboximidamide
- (3aβ,3bα,7aβ)-2-(4-Methoxybenzyl)-7α-(4-amidinophenyl)decahydro-2,6a-diaza-6aH-cyclopenta[a]pentalene-1,3-dione
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