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经验公式(希尔记法):
C29H41F2N5O
化学文摘社编号:
分子量:
513.67
UNSPSC Code:
12352200
PubChem Substance ID:
NACRES:
NA.77
MDL number:
产品名称
马拉韦罗, ≥98% (HPLC)
SMILES string
CC(C)c1nnc(C)n1[C@H]2C[C@@H]3CC[C@H](C2)N3CC[C@H](NC(=O)C4CCC(F)(F)CC4)c5ccccc5
InChI key
GSNHKUDZZFZSJB-QYOOZWMWSA-N
InChI
1S/C29H41F2N5O/c1-19(2)27-34-33-20(3)36(27)25-17-23-9-10-24(18-25)35(23)16-13-26(21-7-5-4-6-8-21)32-28(37)22-11-14-29(30,31)15-12-22/h4-8,19,22-26H,9-18H2,1-3H3,(H,32,37)/t23-,24+,25-,26-/m0/s1
assay
≥98% (HPLC)
form
powder
optical activity
[α]-15/D
color
white
solubility
DMSO: >30 mg/mL
storage temp.
room temp
Quality Level
Gene Information
human ... CCR5(1234)
Application
马拉韦罗用作小鼠单核细胞/巨噬细胞系J774A.1、猪子宫腔上皮细胞和人肺CD4+ T细胞中的C-C趋化因子受体5型(CCR5特异性)抑制剂。
Biochem/physiol Actions
马拉韦罗是一种 CCR5 趋化因子受体拮抗剂和抗逆转录病毒条目抑制剂。
马拉韦罗是一种 CCR5 趋化因子受体拮抗剂和抗逆转录病毒条目抑制剂。马拉韦罗通过阻断病毒外壳蛋白 gp120 与受体的相互作用而抑制 HIV 条目
马拉韦罗通过细胞色素P450 3A4代谢。马拉韦罗在肠道和胆汁中的转运和吸收受p-糖蛋白(Pgp)的调控。马拉韦罗与趋化因子受体CCR5的活性部位组织结合,使受体失去活性。
存储类别
11 - Combustible Solids
flash_point_f
Not applicable
flash_point_c
Not applicable
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Tan Q, et al.
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