Name: LF11
Rating: 5 (10 reviews)

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HIT ID:HIT212709525
Cas No:832729-13-2
常用名:LF11
别名:LF 11
IUPAC:(2R)-2-{[(2R)-2-{[(2R)-2-{[(2S)-2-amino-1-hydroxy-3-phenylpropylidene]amino}-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino}-N-[(1R)-1-{[(1R)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-4-carbamimidamido-1-(C-hydroxycarbonimidoyl)butyl]-C-hydroxycarbonimidoyl}-2-methylpropyl]-C-hydroxycarbonimidoyl}pentyl]-C-hydroxycarbonimidoyl}-4-carbamimidamidobutyl]-C-hydroxycarbonimidoyl}-2-methylbutyl]-C-hydroxycarbonimidoyl}-2-(C-hydroxycarbonimidoyl)ethyl]-C-hydroxycarbonimidoyl}-4-carbamimidamidobutyl]pentanediimidic acid
IUPAC:(2R)-2-{[(2R)-2-{[(2R)-2-{[(2S)-2-amino-1-hydroxy-3-phenylpropylidene]amino}-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino}-N-[(1R)-1-{[(1R)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-4-carbamimidamido-1-(C-hydroxycarbonimidoyl)butyl]-C-hydroxycarbonimidoyl}-2-methylpropyl]-C-hydroxycarbonimidoyl}pentyl]-C-hydroxycarbonimidoyl}-4-carbamimidamidobutyl]-C-hydroxycarbonimidoyl}-2-methylbutyl]-C-hydroxycarbonimidoyl}-2-(C-hydroxycarbonimidoyl)ethyl]-C-hydroxycarbonimidoyl}-4-carbamimidamidobutyl]pentanediimidic acid
InChI key:SIROSQHTQDVQTI-JDJCIBPGSA-N

分子式:C69H112N26O14
分子量:1529.823
氢键供体数 (HBD):30
氢键受体数 (HBA):39
LogP:-1.5795462
SMILES:[H][C@](N)(Cc1ccccc1)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=N[C@@]([H])(Cc1c[nH]c2ccccc12)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N[C@@]([H])(CC(O)=N)C(O)=N[C@]([H])(C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N[C@@]([H])(CCCCN)C(O)=N[C@@]([H])(C(C)C)C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N)[C@@]([H])(C)CC |w:66.69,57.60,45.48,35.38,20.21,10.11,71.74,83.86,93.96,101.104|
SMILES:[H][C@](N)(Cc1ccccc1)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=N[C@@]([H])(Cc1c[nH]c2ccccc12)C(O)=N[C@@]([H])(CCC(O)=N)C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N[C@@]([H])(CC(O)=N)C(O)=N[C@]([H])(C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N[C@@]([H])(CCCCN)C(O)=N[C@@]([H])(C(C)C)C(O)=N[C@@]([H])(CCCNC(N)=N)C(O)=N)[C@@]([H])(C)CC |w:66.69,57.60,45.48,35.38,20.21,10.11,71.74,83.86,93.96,101.104|

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