oxytocin, 1'-(1'-methyl-4'-thiopiperidine)acetic acid-

• 常用名: oxytocin, 1'-(1'-methyl-4'-thiopiperidine)acetic acid-
• 英文名: oxytocin, 1'-(1'-methyl-4'-thiopiperidine)acetic acid-
• CAS号: 113789-44-9
• 分子量: 1075.30000
• 密度: 1.37g/cm3
• 沸点: 1521.5ºC at 760 mmHg
• 分子式: C₄₈H₇₄N₁₂O₁₂S₂
• 熔点: N/A
• 闪点: 874ºC

名称

• 英文名: (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(10R,13S,16S,22S)-13-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-19-[(2S)-butan-2-yl]-22-[(4-hydroxyphenyl)methyl]-3-methyl-12,15,18,21,24-pentaoxo-7,8-dithia-3,11,14,17,20,23-hexa

物理化学性质

• 密度: 1.37g/cm3
• 沸点: 1521.5ºC at 760 mmHg
• 分子式: C₄₈H₇₄N₁₂O₁₂S₂
• 分子量: 1075.30000
• 闪点: 874ºC
• 精确质量: 1074.50000
• PSA: 454.75000
• LogP: 4.30360
• InChIKey: KCJUGLUYVHOSJK-DCFRFDPNSA-N
• SMILES: CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)CC2(CCN(C)CC2)SSCC(C(=O)N2CCCC2C(=O)NC(CC(C)C)C(=O)NCC(N)=O)NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O
• 蒸汽压: 0mmHg at 25°C
• 折射率: 1.63

英文别名

• 1'-(1'-Methyl-4'-thiopiperidine)acetic acid oxytocin
• (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(10S,16S,19S,22R)-19-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-10-[(4-hydroxyphenyl)methyl]-3-methyl-8,11,14,17,20-pentaoxo-24,25-dithia-3,9,12,15,18,21-hexazaspiro[5.19]pentacosane-22-carbonyl]pyrrolidine-2
• Oxytocin,1'-(1'-methyl-4'-thiopiperidine)acetic acid
• Mepaot
• Oxytocin,1-(4-mercapto-1-methyl-4-piperidineacetic acid)