Chem
J-GLOBAL ID：200907057179234086   Nikkaji number：J1.399.883C

(10S,13S)-13-[(R)-1-Hydroxy-2-[isopentyl(4-aminophenylsulfonyl)amino]ethyl]-10-isopropyl-2-oxa-9,12-diazabicyclo[13.2.2]nonadeca-1(18),15(19),16-triene-8,11-dione

N-イソペンチル-N-[(2R)-2-ヒドロキシ-2-[(3S,6S)-6-イソプロピル-5,8-ジオキソ-4,7-ジアザ-14-オキサビシクロ[13.2.2]ノナデカ-1(17),15,18-トリエン-3-イル]エチル]-4-アミノベンゼンスルホンアミド
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： C32H48N4O6S
Molecular formula furigana： C32-H48-N4-O6-S
Molecular weight： 616.820
InChI： InChI=1S/C32H48N4O6S/c1-22(2)17-18-36(43(40,41)27-15-11-25(33)12-16-27)21-29(37)28-20-24-9-13-26(14-10-24)42-19-7-5-6-8-30(38)35-31(23(3)4)32(39)34-28/h9-16,22-23,28-29,31,37H,5-8,17-21,33H2,1-4H3,(H,34,39)(H,35,38)/t28-,29+,31-/m0/s1
InChI key： FBNSKSOTNMECSA-FLBADVGZSA-N
SMILES： CC(C)CCN(C[C@@H](O)[C@@H]1Cc2ccc(OCCCCCC(=O)N[C@@H](C(C)C)C(=O)N1)cc2)S(=O)(=O)c1ccc(N)cc1
Systematic name  (5)：
  • (10S,13S)-13-[(R)-1-ヒドロキシ-2-[イソペンチル(4-アミノフェニルスルホニル)アミノ]エチル]-10-イソプロピル-2-オキサ-9,12-ジアザビシクロ[13.2.2]ノナデカ-1(18),15(19),16-トリエン-8,11-ジオン
  • 4-アミノ-N-(3-メチルブチル)-N-[(2R)-2-ヒドロキシ-2-[(3S,6S)-6-イソプロピル-5,8-ジオキソ-14-オキサ-4,7-ジアザビシクロ[13.2.2]ノナデカ-1(18),15(19),16-トリエン-3-イル]エチル]ベンゼンスルホンアミド
  • 4-アミノ-N-[(2R)-2-[(10S,13S)-8,11-ジオキソ-10-(プロパン-2-イル)-2-オキサ-9,12-ジアザビシクロ[13.2.2]ノナデカ-1(17),15,18-トリエン-13-イル]-2-ヒドロキシエチル]-N-(3-メチルブチル)ベンゼン-1-スルホンアミド
  • 4-amino-N-[(2R)-2-[(10S,13S)-8,11-dioxo-10-(propan-2-yl)-2-oxa-9,12-diazabicyclo[13.2.2]nonadeca-1(17),15,18-trien-13-yl]-2-hydroxyethyl]-N-(3-methylbutyl)benzene-1-sulfonamide
  • N-イソペンチル-N-[(2R)-2-ヒドロキシ-2-[(3S,6S)-6-イソプロピル-5,8-ジオキソ-4,7-ジアザ-14-オキサビシクロ[13.2.2]ノナデカ-1(17),15,18-トリエン-3-イル]エチル]-4-アミノベンゼンスルホンアミド
Other name (2)：
  • (10S,13S)-13-[(R)-1-Hydroxy-2-[isopentyl(4-aminophenylsulfonyl)amino]ethyl]-10-isopropyl-2-oxa-9,12-diazabicyclo[13.2.2]nonadeca-1(18),15(19),16-triene-8,11-dione
  • 4-Amino-N-(3-methylbutyl)-N-[(2R)-2-hydroxy-2-[(3S,6S)-6-isopropyl-5,8-dioxo-14-oxa-4,7-diazabicyclo[13.2.2]nonadeca-1(18),15(19),16-triene-3-yl]ethyl]benzenesulfonamide
Thsaurus map：
Thesaurus Map

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