Chem
J-GLOBAL ID:200907044355524938
Nikkaji number:J2.517.782G
GRL-0026A
(3R)-N-[(1S,2R)-1-ベンジル-2-ヒドロキシ-3-[2-メチルプロピル[(4-メトキシフェニル)スルホニル]アミノ]プロピル]-2,3,3aβ,4,5,6aβ-ヘキサヒドロフロ[2,3-b]フラン-3α-アセトアミド
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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:
C29 H40 N2 O7 S
Molecular formula furigana:
C29-H40-N2-O7-S
Molecular weight:
560.710
InChI:
InChI=1S/C29H40N2O7S/c1-20(2)17-31(39(34,35)24-11-9-23(36-3)10-12-24)18-27(32)26(15-21-7-5-4-6-8-21)30-28(33)16-22-19-38-29-25(22)13-14-37-29/h4-12,20,22,25-27,29,32H,13-19H2,1-3H3,(H,30,33)/t22-,25-,26-,27+,29+/m0/s1
InChI key:
ZMLZLWMYQDSDEB-VPWBKDPUSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C[C@H]1CO[C@H]2OCC[C@@H]12
Systematic name (3):
(3R)-N-[(1S,2R)-1-ベンジル-2-ヒドロキシ-3-[2-メチルプロピル[(4-メトキシフェニル)スルホニル]アミノ]プロピル]-2,3,3aβ,4,5,6aβ-ヘキサヒドロフロ[2,3-b]フラン-3α-アセトアミド
2-[(3R,3aS,6aR)-ヘキサヒドロフロ[2,3-b]フラン-3-イル]-N-[(2S,3R)-3-ヒドロキシ-4-[N-(2-メチルプロピル)4-メトキシベンゼンスルホンアミド]-1-フェニルブタン-2-イル]アセトアミド
2-[(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl]-N-[(2S,3R)-3-hydroxy-4-[N-(2-methylpropyl)4-methoxybenzenesulfonamido]-1-phenylbutan-2-yl]acetamide
Other name (2):
(3R)-N-[(1S,2R)-1-Benzyl-2-hydroxy-3-[2-methylpropyl[(4-methoxyphenyl)sulfonyl]amino]propyl]-2,3,3aβ,4,5,6aβ-hexahydrofuro[2,3-b]furan-3α-acetamide
GRL-0026A
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