Name: Lys-Bradykinin
Rating: 5 (10 reviews)

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HIT ID:HIT212709527
Cas No:342-10-9
常用名:Lys-Bradykinin
IUPAC:(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2R)-2-(2-{[(2S)-1-[(2S)-1-[(2S)-2-[(2S)-2,6-diaminohexanamido]-5-[(diaminomethylidene)amino]pentanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]formamido}acetamido)-3-phenylpropanamido]-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]-5-[(diaminomethylidene)amino]pentanoic acid
IUPAC:(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2R)-2-(2-{[(2S)-1-[(2S)-1-[(2S)-2-[(2S)-2,6-diaminohexanamido]-5-[(diaminomethylidene)amino]pentanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]formamido}acetamido)-3-phenylpropanamido]-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]-5-[(diaminomethylidene)amino]pentanoic acid
InChI key:FYSKZKQBTVLYEQ-FSLKYBNLSA-N

分子式:C56H85N17O12
分子量:1188.403
氢键供体数 (HBD):14
氢键受体数 (HBA):20
LogP:-7.0006256
SMILES:[H][C@]([#7])([#6]-[#6]-[#6]-[#6]-[#7])[#6](=O)-[#7][C@@]([H])([#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7]-[#6]-[#6](=O)-[#7][C@@]([H])([#6]-c1ccccc1)[#6](=O)-[#7][C@@]([H])([#6]-[#8])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7][C@@]([H])([#6]-c1ccccc1)[#6](=O)-[#7][C@@]([H])([#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])[#6](-[#8])=O
SMILES:[H][C@]([#7])([#6]-[#6]-[#6]-[#6]-[#7])[#6](=O)-[#7][C@@]([H])([#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7]-[#6]-[#6](=O)-[#7][C@@]([H])([#6]-c1ccccc1)[#6](=O)-[#7][C@@]([H])([#6]-[#8])[#6](=O)-[#7]1-[#6]-[#6]-[#6][C@@]1([H])[#6](=O)-[#7][C@@]([H])([#6]-c1ccccc1)[#6](=O)-[#7][C@@]([H])([#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])[#6](-[#8])=O

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