Chem
J-GLOBAL ID:200907027338432424
Nikkaji number:J1.472.241F
3-[[(2,4-Dihydroxyphenyl)acetyl]amino]-4-oxo-4-(1,4,8,11-tetraazacyclotetradecane-1-yl)butanamide
3-[2-(2,4-ジヒドロキシフェニル)アセトアミド]-4-オキソ-4-(1,4,8,11-テトラアザシクロテトラデカン-1-イル)ブタンアミド
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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:
C22 H36 N6 O5
Molecular formula furigana:
C22-H36-N6-O5
Molecular weight:
464.567
InChI:
InChI=1S/C22H36N6O5/c23-20(31)15-18(27-21(32)13-16-3-4-17(29)14-19(16)30)22(33)28-11-2-7-25-9-8-24-5-1-6-26-10-12-28/h3-4,14,18,24-26,29-30H,1-2,5-13,15H2,(H2,23,31)(H,27,32)
InChI key:
DFHBUDPDOOKHBA-UHFFFAOYSA-N
SMILES:
NC(=O)CC(NC(=O)Cc1ccc(O)cc1O)C(=O)N1CCCNCCNCCCNCC1
Systematic name (3):
3-[[(2,4-ジヒドロキシフェニル)アセチル]アミノ]-4-オキソ-4-(1,4,8,11-テトラアザシクロテトラデカン-1-イル)ブタンアミド
3-[2-(2,4-ジヒドロキシフェニル)アセトアミド]-4-オキソ-4-(1,4,8,11-テトラアザシクロテトラデカン-1-イル)ブタンアミド
3-[2-(2,4-dihydroxyphenyl)acetamido]-4-oxo-4-(1,4,8,11-tetraazacyclotetradecan-1-yl)butanamide
Other name (1):
3-[[(2,4-Dihydroxyphenyl)acetyl]amino]-4-oxo-4-(1,4,8,11-tetraazacyclotetradecane-1-yl)butanamide
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