Chem
J-GLOBAL ID:201007009037987512
Nikkaji number:J2.778.497F
L1H1-7OTD
N,2-[(S)-(4-アミノブチル)メチレン]-4,2′:4′,2′′:4′′,2′′′:4′′′,2′′′′:4′′′′,2′′′′′:4′′′′′,2′′′′′′-セプチオキサゾール-4′′′′′′-カルボアミド
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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:
C27 H19 N9 O8
Molecular formula furigana:
C27-H19-N9-O8
Molecular weight:
597.504
InChI:
InChI=1S/C27H19N9O8/c28-4-2-1-3-12-21-31-15(6-39-21)23-33-17(8-41-23)25-35-19(10-43-25)27-36-18(11-44-27)26-34-16(9-42-26)24-32-14(7-40-24)22-30-13(5-38-22)20(37)29-12/h5-12H,1-4,28H2,(H,29,37)/t12-/m0/s1
InChI key:
GFOKPRHABUNOTO-LBPRGKRZSA-N
SMILES:
NCCCC[C@@H]1NC(=O)c2coc(n2)c2coc(n2)c2coc(n2)c2coc(n2)c2coc(n2)c2coc(n2)c2coc1n2
Systematic name (6):
(4S)-4-(4-アミノブチル)-6,10,14,18,22,26,30-ヘプタオキサ-3,32,33,34,35,36,37,38-オクタアザオクタシクロ[27.2.1.15,8 .19,12 .113,16 .117,20 .121,24 .125,28 ]オクタトリアコンタン-1(31),5(38),7,9(37),11,13(36),15,17(35),19,21(34),23,25(33),27,29(32)-テトラデカエン-2-オン
(3S)-3α-(4-アミノブチル)-6,9:10,13:14,17:18,21:22,25:26,29:30,2-ヘプタエピニトリロ-1,8,12,16,20,24,28-ヘプタオキサ-4-アザシクロヘントリアコンタ-6,10,14,18,22,26,30-ヘプタエン-5-オン
N,2-[(S)-(4-アミノブチル)メチレン]-4,2′:4′,2′′:4′′,2′′′:4′′′,2′′′′:4′′′′,2′′′′′:4′′′′′,2′′′′′′-セプチオキサゾール-4′′′′′′-カルボアミド
(3S)-1,3-[4,2-オキサゾールジイル(4,2-オキサゾールジイル)(4,2-オキサゾールジイル)(4,2-オキサゾールジイル)(4,2-オキサゾールジイル)(4,2-オキサゾールジイル)(4,2-オキサゾールジイル)]-7-アミノ-2-アザヘプタン-1-オン
(28S)-28-(4-アミノブチル)-3,7,11,15,19,23,30-ヘプタオキサ-27,32,33,34,35,36,37,38-オクタアザオクタシクロ[27.2.1.12,5 .16,9 .110,13 .114,17 .118,21 .122,25 ]オクタトリアコンタ-1(31),2(38),4,6(37),8,10(36),12,14(35),16,18(34),20,22(33),24,29(32)-テトラデカエン-26-オン
(28S)-28-(4-aminobutyl)-3,7,11,15,19,23,30-heptaoxa-27,32,33,34,35,36,37,38-octaazaoctacyclo[27.2.1.12,5 .16,9 .110,13 .114,17 .118,21 .122,25 ]octatriaconta-1(31),2(38),4,6(37),8,10(36),12,14(35),16,18(34),20,22(33),24,29(32)-tetradecaen-26-one
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Other name (5):
(4S)-4-(4-Aminobutyl)-6,10,14,18,22,26,30-heptaoxa-3,32,33,34,35,36,37,38-octaazaoctacyclo[27.2.1.15,8 .19,12 .113,16 .117,20 .121,24 .125,28 ]octatriacontane-1(31),5(38),7,9(37),11,13(36),15,17(35),19,21(34),23,25(33),27,29(32)-tetradecaene-2-one
(3S)-3α-(4-Aminobutyl)-6,9:10,13:14,17:18,21:22,25:26,29:30,2-heptaepinitrilo-1,8,12,16,20,24,28-heptaoxa-4-azacyclohentriaconta-6,10,14,18,22,26,30-heptaene-5-one
N,2-[(S)-(4-Aminobutyl)methylene]-4,2′:4′,2′′:4′′,2′′′:4′′′,2′′′′:4′′′′,2′′′′′:4′′′′′,2′′′′′′-septioxazole-4′′′′′′-carboxamide
(3S)-1,3-[4,2-Oxazolediyl(4,2-oxazolediyl)(4,2-oxazolediyl)(4,2-oxazolediyl)(4,2-oxazolediyl)(4,2-oxazolediyl)(4,2-oxazolediyl)]-7-amino-2-azaheptane-1-one
L1H1-7OTD
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