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精氨酰-甘氨酰-天冬氨酰-丝氨酸 | 91037-65-9

精氨酰-甘氨酰-天冬氨酰-丝氨酸
Arg-gly-asp-ser
91037-65-9
C15H27N7O8
433.416982889175
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:精氨酰-甘氨酰-天冬氨酰-丝氨酸结构式
24891220
简介
Arg-Gly-Asp-Ser 是整联蛋白结合序列,抑制整联蛋白受体 (integrin receptor) 功能。Arg-Gly-Asp-Ser 直接并特异性地结合 pro-caspase-8,pro-caspase-9 和 pro-caspase-3,但不与 pro-caspase-1 结合。
名称和标识符
MDL MFCD00076452
InChIKey NNRFRJQMBSBXGO-CIUDSAMLSA-N
Inchi 1S/C15H27N7O8/c16-7(2-1-3-19-15(17)18)12(27)20-5-10(24)21-8(4-11(25)26)13(28)22-9(6-23)14(29)30/h7-9,23H,1-6,16H2,(H,20,27)(H,21,24)(H,22,28)(H,25,26)(H,29,30)(H4,17,18,19)/t7-,8-,9-/m0/s1
SMILES [C@@H](CC(=O)O)(NC(=O)CNC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)O
别名信息
- 中文别名 -
  • H-精氨酸-甘氨酸-天冬氨酸-丝氨酸-OH
  • 精氨酰-甘氨酰-天冬氨酰-丝氨酸
  • L-精氨酰甘氨酰-L-alpha-天冬氨酰-L-丝氨酸
- 英文别名 -
  • L-Serine,L-arginylglycyl-L-a-aspartyl-
  • Arg-Gly-Asp-Ser
  • arginyl-glycyl-aspartyl-serine
  • H-Arg-Gly-Asp-Ser-OH
  • RGDS
  • RGDS peptide
  • 2ACOH 2H2O
  • Arg-Gly-Asp-Ser-OH
  • fibronectin active fragment
  • FIBRONECTIN INHIBITOR
  • L-ARG-GLY-ASP-SER
  • L-Arg-Gly-L-Asp-L-Ser-OH
  • RGDS 1
  • Palmitoyl Oligopertide
  • Fibronectin tetrapeptide
  • C15H27N7O8
  • L-Arginylglycyl-L-alpha-aspartyl-L-serine
  • L-Serine, L-arginylglycyl-L-alpha-aspartyl-
  • L-Serine, N-(N-(N-L-arginylglycyl)-L-alpha-aspartyl)-
  • AK163508
  • 3-[(S)-2-((S)-2-Amino-5-guanidino-pentanoylamino)-acetylamino]-N-(1-carboxy-2-hydroxy-ethyl)-succinamic acid
  • BDBM50241180
  • 3450AH
  • AKO
  • L-Arginylglycyl-L-α-aspartyl-L-serine (ACI)
  • L-Serine, N-[N-(N-L-arginylglycyl)-L-α-aspartyl]- (ZCI)
  • 102: PN: WO2008113030 SEQID: 103 unclaimed sequence
  • 10: PN: JP2003089648 SEQID: 11 unclaimed
  • 10: PN: WO03099465 SEQID: 11 claimed protein
  • 10: PN: WO2020081717 SEQID: 10 claimed protein
  • 110: PN: US20100136614 SEQID: 111 unclaimed sequence
  • 11: PN: US20050142094 SEQID: 11 unclaimed sequence
  • 11: PN: WO2013007839 SEQID: 52 claimed protein
  • 12: PN: JP2004000070 SEQID: 14 unclaimed protein
  • 12: PN: WO0044808 TABLE: 4 unclaimed sequence
  • 12: PN: WO03089607 SEQID: 12 claimed sequence
  • 13: PN: US20100028387 SEQID: 13 claimed protein
  • 13: PN: US20140004158 SEQID: 14 claimed sequence
  • 13: PN: US6111069 SEQID: 6 claimed protein
  • 13: PN: WO2017072759 SEQID: 13 claimed sequence
  • 14: PN: JP2003210166 SEQID: 14 claimed protein
  • 14: PN: JP2004049921 SEQID: 14 unclaimed protein
  • 16: PN: EP3415165 SEQID: 16 claimed protein
  • 16: PN: KR20140027031 SEQID: 17 claimed protein
  • 16: PN: WO0105991 SEQID: 17 unclaimed sequence
  • 16: PN: WO2022027020 PAGE: 57 claimed sequence
  • 172: PN: US20080107614 SEQID: 134 unclaimed sequence
  • 18: PN: US20040228913 SEQID: 11 claimed sequence
  • 18: PN: US6147189 SEQID: 6 claimed protein
  • 18: PN: WO2011163398 SEQID: 15 unclaimed protein
  • 1: PN: JP2002369878 SEQID: 11 unclaimed sequence
  • 1: PN: JP2007230891 SEQID: 1 claimed protein
  • 1: PN: JP2008195682 SEQID: 1 unclaimed protein
  • 1: PN: JP2008195683 SEQID: 1 unclaimed protein
  • 1: PN: JP2023038840 SEQID: 1 claimed sequence
  • 1: PN: KR20150027940 SEQID: 2 claimed sequence
  • 1: PN: US20040023391 PAGE: 9 claimed protein
  • 1: PN: US20150064143 SEQID: 1 claimed sequence
  • 1: PN: US6013628 SEQID: 16 unclaimed protein
  • 1: PN: US6043216 SEQID: 1 claimed sequence
  • 1: PN: WO0178529 PAGE: 26 unclaimed sequence
  • 1: PN: WO0187071 SEQID: 2 unclaimed sequence
  • 1: PN: WO2012124998 SEQID: 3 claimed protein
  • 1: PN: WO2012135813 PAGE: 8 claimed protein
  • 1: PN: WO2014172355 SEQID: 1 claimed protein
  • 1: PN: WO2017036533 SEQID: 1 claimed protein
  • 1: PN: WO2017040335 SEQID: 210 claimed sequence
  • 1: PN: WO2017059312 SEQID: 1 claimed sequence
  • 1: PN: WO2017160862 SEQID: 7 claimed protein
  • 1: PN: WO2018201051 SEQID: 383 claimed protein
  • 1: PN: WO2019104154 SEQID: 1 claimed protein
  • 1: PN: WO2020097235 SEQID: 31 claimed sequence
  • 1: PN: WO2022234536 SEQID: 1 claimed protein
  • 1: PN: WO2023038068 SEQID: 1 claimed protein
物化性质
实验特性
LogP -1.72170
PSA 270.05000
折射率 1.659
水溶性 Soluble in water at 1mg/ml
沸点 °Cat760mmHg
熔点 183-187 ºC
闪点 °C
溶解度 易溶 (110 g/L) (25 ºC),
颜色与性状 固体
溶解性 未确定
密度 1.65±0.1 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 433.19200
氢键供体数量 9
氢键受体数量 10
可旋转化学键数量 14
同位素质量 433.192111
重原子数量 30
复杂度 665
同位素原子数量 0
确定原子立构中心数量 3
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) -7.3
互变异构体数量 16
表面电荷 0
拓扑分子极性表面积 273
合成路线

合成路线:1 步

反应条件:
参考文献:
Improved anti-osteoporosis potency and reduced endometrial membrane hyperplasia during hormone replacement therapy with estrogen-RGD peptide conjugates
Xiong, Yu; Zhao, Ming; Wang, Chao; Chang, Heng Wei; Peng, Shiqi, Journal of Medicinal Chemistry, 2007, 50(14), 3340-3353

合成路线:1 步

反应条件:
参考文献:
Preparation of N-tridecyl-RGD peptide as target cation pharmacosome
, China, , ,
相关文献
专业数据库参考
PubChemId 24891220
参考资料
Reaxys RN
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