Name: Rusalatide acetate (497221-38-2 free base)
Rating: 5 (10 reviews)

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HIT ID:HIT212659491
Cas No:875455-82-6
常用名:Rusalatide acetate (497221-38-2 free base)
常用名:Rusalatide acetate (497221-38-2 free base)
别名:TP508 amide acetate, Rusalatide acetate
IUPAC:4-({[(5-amino-1-{[4-carbamimidamido-1-({[(1-{[1-({1-[(1-{[({1-[(1-{[({2-[2-({1-[(1-carbamoyl-2-methylpropyl)carbamoyl]-2-phenylethyl}carbamoyl)pyrrolidin-1-yl]-2-oxoethyl}carbamoyl)methyl]carbamoyl}-2-hydroxyethyl)carbamoyl]-2-carboxyethyl}carbamoyl)methyl]carbamoyl}-3-carboxypropyl)carbamoyl]-2-sulfanylethyl}carbamoyl)ethyl]carbamoyl}-2-carboxyethyl)carbamoyl]methyl}carbamoyl)butyl]carbamoyl}pentyl)carbamoyl]methyl}carbamoyl)-4-(2-{[1-(6-amino-2-{2-[2-(2-aminopropanamido)acetamido]-3-(4-hydroxyphenyl)propanamido}hexanoyl)pyrrolidin-2-yl]formamido}-3-carboxypropanamido)butanoic acid; acetic acid
IUPAC:4-({[(5-amino-1-{[4-carbamimidamido-1-({[(1-{[1-({1-[(1-{[({1-[(1-{[({2-[2-({1-[(1-carbamoyl-2-methylpropyl)carbamoyl]-2-phenylethyl}carbamoyl)pyrrolidin-1-yl]-2-oxoethyl}carbamoyl)methyl]carbamoyl}-2-hydroxyethyl)carbamoyl]-2-carboxyethyl}carbamoyl)methyl]carbamoyl}-3-carboxypropyl)carbamoyl]-2-sulfanylethyl}carbamoyl)ethyl]carbamoyl}-2-carboxyethyl)carbamoyl]methyl}carbamoyl)butyl]carbamoyl}pentyl)carbamoyl]methyl}carbamoyl)-4-(2-{[1-(6-amino-2-{2-[2-(2-aminopropanamido)acetamido]-3-(4-hydroxyphenyl)propanamido}hexanoyl)pyrrolidin-2-yl]formamido}-3-carboxypropanamido)butanoic acid; acetic acid
InChI key:MVJQTKJKSNUAQI-UHFFFAOYSA-N

分子式:C99H151N29O37S
分子量:2371.52
氢键供体数 (HBD):35
氢键受体数 (HBA):41
LogP:-23.695778
SMILES:CC(O)=O.CC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)C1CCCN1C(=O)CNC(=O)CNC(=O)C(CO)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CCC(O)=O)NC(=O)C(CS)NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CCCNC(N)=N)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CNC(=O)C(C)N)C(N)=O
SMILES:CC(O)=O.CC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)C1CCCN1C(=O)CNC(=O)CNC(=O)C(CO)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CCC(O)=O)NC(=O)C(CS)NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CCCNC(N)=N)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C1CCCN1C(=O)C(CCCCN)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CNC(=O)C(C)N)C(N)=O

Rusalatide acetate (TP508 amide acetate) 是一种再生肽，可诱导干细胞再生修复，保护隐窝完整性，减缓辐照引起的胃肠道损伤。

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