Chem
J-GLOBAL ID:200907090051176773
Nikkaji number:J1.893.651H
SP-4206
1-メチル-3-[2,3-ジクロロ-4-(5-カルボキシフルフリルオキシ)フェニル]-5-[1-[N-(アミノイミノメチル)-D-Leu-Gly-]ピペリジン-4-イル]-1H-ピラゾール
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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:
C30 H37 Cl2 N7 O6
Molecular formula furigana:
C30-H37-CL2-N7-O6
Molecular weight:
662.570
InChI:
InChI=1S/C30H37Cl2N7O6/c1-16(2)12-21(36-30(33)34)28(41)35-14-25(40)39-10-8-17(9-11-39)22-13-20(37-38(22)3)19-5-7-23(27(32)26(19)31)44-15-18-4-6-24(45-18)29(42)43/h4-7,13,16-17,21H,8-12,14-15H2,1-3H3,(H,35,41)(H,42,43)(H4,33,34,36)/t21-/m1/s1
InChI key:
VNZHOIDQBPFEJU-OAQYLSRUSA-N
SMILES:
CC(C)C[C@@H](NC(=N)N)C(=O)NCC(=O)N1CCC(CC1)c1cc(nn1C)c1ccc(OCc2ccc(o2)C(=O)O)c(Cl)c1Cl
Systematic name (5):
(2R)-N-[2-オキソ-2-[4-[1-メチル-3-[2,3-ジクロロ-4-[(5-カルボキシ-2-フリル)メトキシ]フェニル]-1H-ピラゾール-5-イル]-1-ピペリジニル]エチル]-2-グアニジノ-4-メチルペンタンアミド
1-メチル-3-[2,3-ジクロロ-4-(5-カルボキシフルフリルオキシ)フェニル]-5-[1-[N-(アミノイミノメチル)-D-Leu-Gly-]ピペリジン-4-イル]-1H-ピラゾール
5-[[4-[5-[1-[[[(R)-2-(アミジノアミノ)-4-メチルペンタノイル]アミノ]アセチル]ピペリジン-4-イル]-1-メチル-1H-ピラゾール-3-イル]-2,3-ジクロロフェノキシ]メチル]フラン-2-カルボン酸
5-({4-[5-(1-{2-[(2R)-2-カルバムイミドアミド-4-メチルペンタンアミド]アセチル}ピペリジン-4-イル)-1-メチル-1H-ピラゾール-3-イル]-2,3-ジクロロフェノキシ}メチル)フラン-2-カルボン酸
5-({4-[5-(1-{2-[(2R)-2-carbamimidamido-4-methylpentanamido]acetyl}piperidin-4-yl)-1-methyl-1H-pyrazol-3-yl]-2,3-dichlorophenoxy}methyl)furan-2-carboxylic acid
Other name (4):
(2R)-N-[2-Oxo-2-[4-[1-methyl-3-[2,3-dichloro-4-[(5-carboxy-2-furyl)methoxy]phenyl]-1H-pyrazole-5-yl]-1-piperidinyl]ethyl]-2-guanidino-4-methylpentanamide
1-Methyl-3-[2,3-dichloro-4-(5-carboxyfurfuryloxy)phenyl]-5-[1-[N-(aminoiminomethyl)-D-Leu-Gly-]piperidine-4-yl]-1H-pyrazole
5-[[4-[5-[1-[[[(R)-2-(Amidinoamino)-4-methylpentanoyl]amino]acetyl]piperidine-4-yl]-1-methyl-1H-pyrazole-3-yl]-2,3-dichlorophenoxy]methyl]furan-2-carboxylic acid
SP-4206
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