[2S-[2alpha,5alpha,6beta(S*)]]-6-[[[(3-甲氧基-1-甲基-3-氧代丙-1-烯基)氨基]苯基乙酰基]氨基]-3,3-二甲基-7-氧代-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸钠
[CAS# 64099-47-4]

基本信息

• 产品名称: [2S-[2alpha,5alpha,6beta(S*)]]-6-[[[(3-甲氧基-1-甲基-3-氧代丙-1-烯基)氨基]苯基乙酰基]氨基]-3,3-二甲基-7-氧代-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸钠
• 英文名: Sodium [2S-[2alpha,5alpha,6beta(S*)]]-6-[[[(3-Methoxy-1-Methyl-3-Oxoprop-1-Enyl)Amino]Phenylacetyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
• 别名: Sodium (2S,5R,6R)-6-[[2-[[(E)-3-Methoxy-1-Methyl-3-Oxo-Prop-1-Enyl]Amino]-2-Phenyl-Acetyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Sodium (2S,5R,6R)-6-[[2-[[(E)-3-Methoxy-1-Methyl-3-Oxoprop-1-Enyl]Amino]-1-Oxo-2-Phenylethyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate; Sodium (2S,5R,6R)-7-Keto-6-[[2-[[(E)-3-Keto-3-Methoxy-1-Methyl-Prop-1-Enyl]Amino]-2-Phenyl-Acetyl]Amino]-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylate
• 分子式: C₂₁H₂₄N₃NaO₆S
• 分子量: 469.49
• CAS 登录号: 64099-47-4
• EINECS 登录号: 264-672-9
• 分子行输入简码 SMILES: [C@H]12SC([C@@H](N1C(=O)[C@H]2NC(=O)C(NC(=C/C(OC)=O)/C)C3=CC=CC=C3)C([O-])=O)(C)C.[Na+]
• 国际化学标识码 InChI: 1S/C21H25N3O6S.Na/c1-11(10-13(25)30-4)22-14(12-8-6-5-7-9-12)17(26)23-15-18(27)24-16(20(28)29)21(2,3)31-19(15)24;/h5-10,14-16,19,22H,1-4H3,(H,23,26)(H,28,29);/q;+1/p-1/b11-10+;/t14?,15-,16+,19-;/m1./s1
• 国际化学标识检索码 InChIKey: YOITVZNCTOLWBV-FIFSFEKOSA-M

物理化学性质

• 沸点: 751.9°C at 760 mmHg （计算值）
• 闪点: 408.5°C （计算值）