Cas(129722-12-9), Aripiprazole-阿拉丁试剂, 阿立哌唑;7-[4-[4-(2, 3-二氯苯基)-1-哌嗪基]丁氧基]-3, 4-二氢-2(1H)-喹啉酮; 7-[4-[4-（2,3-二氯苯基）-1-哌嗪基] 丁氧基]-3,4-二氢-2 (1H)-喹啉酮;7-{4-[4-(2,3-二氯苯基)-L-哌嗪基]丁氧基}-3,4-二氢-2(1H)-喹啉酮,Aripiprazole,

货号 (SKU)	包装规格	是否现货
A124880-1g	1g	现货
A124880-5g	5g	现货
A124880-25g	25g	现货
A124880-100g	100g	现货

基本描述

规格或纯度	≥99%
英文名称	Aripiprazole
别名	阿立哌唑;7-[4-[4-(2, 3-二氯苯基)-1-哌嗪基]丁氧基]-3, 4-二氢-2(1H)-喹啉酮; 7-[4-[4-（2,3-二氯苯基）-1-哌嗪基] 丁氧基]-3,4-二氢-2 (1H)-喹啉酮;7-{4-[4-(2,3-二氯苯基)-L-哌嗪基]丁氧基}-3,4-二氢-2(1H)-喹啉酮
英文别名	Abilify; 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydro-2(1H)-quinolinone; 7-{4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy}-3,4-dihydro-2(1H)-quinolinone
生化机理	An anti-psychotic selective dopamine D2-receptor antagonist with dopamine autoreceptor agonist activity. 阿立哌唑是一种“多巴胺能稳定剂”。它被用作治疗精神分裂症患者的潜在治疗药物。此外，还最好用于治疗 Tourette 综合征 (TS) 患者的注意缺陷多动障碍 (ADHD)。阿立哌唑是第二代非典型抗精神病药和抗抑郁药，对多巴胺 D2 和 5-羟色胺 5-HT1A 受体有部分激动活性，对 5-羟色胺 5-HT2A 受体有拮抗活性。多巴胺 D2 和 D3、5-羟色胺 5-HT1A 和 5-HT2A 受体的 Ki 值 [2] 分别为 0.34 nM、0.8 nM、1.7 nM 和 3.4 nM。阿立哌唑用于精神分裂症的治疗。多巴胺D 2部分激动剂。K i（nM）值为265（D 1），0.34（D 2），0.8（D 3），44（D 4），1.7（5-HT 1A），3.4（5-HT 2A），15（5 -HT 2C），214（5-HT 6），39（5-HT 7），57（α1），791（α2），61（H 1）和> 1000（M 1）。抗精神病药和抗抑郁药
储存温度	-20°C储存
运输条件	超低温冰袋运输
备注	如果有可能，您尽量在使用的当天配置溶液，并在当天使用完它。但是，如果您需要预先配制储备溶液，我们建议您将溶液等份保存在-20°C的密封小瓶中。通常，它们最多可以使用一个月。在使用前和打开样品瓶之前，我们建议您让您的产品在室温下平衡至少1小时。有毒，请参阅SDS以获取更多信息。需要更多关于溶解度，用法和处理的建议吗？请访问我们的常见问题（FAQ）页面以获取更多详细信息。
产品介绍	Aripiprazole是一种人5-HT1A受体激动剂，Ki为4.2 nM。阿立哌唑的主要成分为 3, 4 二氢-2-(1H) 喹啉酮。阿立哌唑已被用于研究其对乳腺肿瘤发生的影响，通过逆转录病毒传递受体酪氨酸蛋白激酶 2 或 HRas 原癌基因、gtp 酶或通过转基因表达 Wnt-1（原癌蛋白）介导。也用于研究其对幼年自发性高血压大鼠的行为和神经化学作用。阿立哌唑已被用于研究阿立哌唑对注意缺陷多动障碍 (ADHD) 模型幼年自发性高血压大鼠 (SHR) 的行为和神经化学的影响。 A selective dopamine D2-receptor antagonist showing autoreceptor agonist activity. Aripiprazole is a human 5-HT1A receptor partial agonist with a Ki of 4.2 nM A selective dopamine D2-receptor antagonist showing autoreceptor agonist activity. Aripiprazole has been used to study behavioral and neurochemical effects of aripiprazole treatment in juvenile spontaneously hypertensive rats (SHR), a model for attention deficit hyperactivity disorder (ADHD). Aripiprazole has been used to study its effect on mammary tumorigenesis, mediated by retrovirus delivery of receptor tyrosine-protein kinase 2 or HRas proto-oncogene, GTPase or by transgenic expression of Wnt-1 (proto-oncoprotein). It has also been used to study its behavioral and neurochemical effects in juvenile spontaneously hypertensive rats.

名称和标识符

IUPAC Name	7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
INCHI	InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
InChi Key	CEUORZQYGODEFX-UHFFFAOYSA-N
Canonical SMILES	C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl
分子式	C₂₃H₂₇Cl₂N₃O₂
PubChem CID	60795
分子量	448.39

数据库链接

PubChem CID	60795
DrugBank Ligand	DB01238
CAS Registry No.	129722-12-9
ChEBI	CHEBI:31236
Wikipedia	Aripiprazole
ChEMBL Ligand	CHEMBL1112
BindingDB Ligand	50130293
PEP	aripiprazole
RCSB PDB Ligand	9SC
DrugCentral Ligand	242
GPCRdb Ligand	aripiprazole

化学和物理性质

溶解性	Soluble in Chloroform and Ethanol；Insoluble in water.
熔点	149 °C

安全信息

象形图	Toxic Harmful
信号词	Danger
危险声明	H301: Toxic if swallowed H302: Harmful if swallowed
预防措施声明	P321,P405,P501,P264,P270,P330,P301+P316,P301+P317
WGK Germany	3
RTECS	VC8275950
Reaxy-Rn	7951706
Merck Index	785

靶标

Target ID

1

名称

5-HT_1A receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	422	2q13	Htr1a	5-hydroxytryptamine receptor 1A
Human	7	422	5q12.3	HTR1A	5-hydroxytryptamine receptor 1A
Mouse	7	421	13 56.92 cM	Htr1a	5-hydroxytryptamine (serotonin) receptor 1A

RefSeq Protein

NP_036717 (Rn) , NP_000515 (Hs) , NP_032334 (Mm)

UniProtKB

P19327 (Rn) , P08908 (Hs) , Q64264 (Mm)

OMIM

109760 (Hs)

RefSeq Nucleotide

NM_000524 (Hs) , NM_012585 (Rn) , NM_008308 (Mm)

Entrez Gene

3350 (Hs) , 24473 (Rn) , 15550 (Mm)

Ensembl Gene

ENSG00000178394 (Hs) , ENSMUSG00000021721 (Mm) , ENSRNOG00000010254 (Rn)

Protein GI

6981054 (Rn) , 55956923 (Hs) , 31542972 (Mm)

GPCRdb

5ht1a_human (Hs) , 5ht1a_mouse (Mm) , 5ht1a_rat (Rn)

UniProtKB ID/Entry name

5HT1A_HUMAN (Hs) , 5HT1A_MOUSE (Mm) , 5HT1A_RAT (Rn)

DrugBank Target

P08908 (Hs)

ChEMBL Target

CHEMBL273 (Rn) , CHEMBL3737 (Mm) , CHEMBL214 (Hs)

Target ID

2

名称

5-HT_1B receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	386	8q31	Htr1b	5-hydroxytryptamine receptor 1B
Human	7	390	6q14.1	HTR1B	5-hydroxytryptamine receptor 1B
Mouse	7	386	9 44.61 cM	Htr1b	5-hydroxytryptamine (serotonin) receptor 1B

RefSeq Protein

NP_071561 (Rn) , NP_000854 (Hs) , NP_034612 (Mm)

UniProtKB

P28564 (Rn) , P28222 (Hs) , P28334 (Mm)

OMIM

182131 (Hs)

RefSeq Nucleotide

NM_000863 (Hs) , NM_022225 (Rn) , NM_010482 (Mm)

Entrez Gene

3351 (Hs) , 25075 (Rn) , 15551 (Mm)

Ensembl Gene

ENSG00000135312 (Hs) , ENSMUSG00000049511 (Mm) , ENSRNOG00000013042 (Rn)

Protein GI

11560016 (Rn) , 6754258 (Mm) , 4504533 (Hs)

GPCRdb

5ht1b_human (Hs) , 5ht1b_mouse (Mm) , 5ht1b_rat (Rn)

UniProtKB ID/Entry name

5HT1B_HUMAN (Hs) , 5HT1B_MOUSE (Mm) , 5HT1B_RAT (Rn)

DrugBank Target

P28222 (Hs)

ChEMBL Target

CHEMBL3459 (Rn) , CHEMBL1898 (Hs) , CHEMBL3708691 (Mm)

Target ID

3

名称

5-HT_1D receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	374	5q36	Htr1d	5-hydroxytryptamine receptor 1D
Human	7	377	1p36.12	HTR1D	5-hydroxytryptamine receptor 1D
Mouse	7	374	4 68.74 cM	Htr1d	5-hydroxytryptamine (serotonin) receptor 1D

RefSeq Protein

NP_036984 (Rn) , NP_000855 (Hs) , NP_032335 (Mm)

UniProtKB

P28565 (Rn) , P28221 (Hs) , Q61224 (Mm)

OMIM

182133 (Hs)

RefSeq Nucleotide

NM_000864 (Hs) , NM_012852 (Rn) , NM_008309 (Mm)

Entrez Gene

3352 (Hs) , 25323 (Rn) , 15552 (Mm)

Ensembl Gene

ENSG00000179546 (Hs) , ENSMUSG00000070687 (Mm) , ENSRNOG00000012038 (Rn)

Protein GI

6981056 (Rn) , 4504535 (Hs) , 31542974 (Mm)

GPCRdb

5ht1d_human (Hs) , 5ht1d_mouse (Mm) , 5ht1d_rat (Rn)

UniProtKB ID/Entry name

5HT1D_HUMAN (Hs) , 5HT1D_MOUSE (Mm) , 5HT1D_RAT (Rn)

DrugBank Target

P28221 (Hs)

ChEMBL Target

CHEMBL1983 (Hs) , CHEMBL5450 (Rn) , CHEMBL4297 (Mm)

Target ID

6

名称

5-HT_2A receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	471	15q11	Htr2a	5-hydroxytryptamine receptor 2A
Human	7	471	13q14.2	HTR2A	5-hydroxytryptamine receptor 2A
Mouse	7	471	14 39.37 cM	Htr2a	5-hydroxytryptamine (serotonin) receptor 2A

RefSeq Protein

NP_058950 (Rn) , NP_000612 (Hs) , NP_766400 (Mm)

UniProtKB

P14842 (Rn) , P28223 (Hs) , P35363 (Mm)

OMIM

182135 (Hs)

RefSeq Nucleotide

NM_000621 (Hs) , NM_017254 (Rn) , NM_172812 (Mm)

Entrez Gene

3356 (Hs) , 29595 (Rn) , 15558 (Mm)

Ensembl Gene

ENSG00000102468 (Hs) , ENSMUSG00000034997 (Mm) , ENSRNOG00000010063 (Rn)

Protein GI

8393583 (Rn) , 260099679 (Hs) , 27753985 (Mm)

GPCRdb

5ht2a_human (Hs) , 5ht2a_mouse (Mm) , 5ht2a_rat (Rn)

UniProtKB ID/Entry name

5HT2A_HUMAN (Hs) , 5HT2A_MOUSE (Mm) , 5HT2A_RAT (Rn)

DrugBank Target

P28223 (Hs)

ChEMBL Target

CHEMBL322 (Rn) , CHEMBL224 (Hs) , CHEMBL5377 (Mm)

Target ID

8

名称

5-HT_2C receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	460	Xq34	Htr2c	5-hydroxytryptamine receptor 2C
Human	7	458	Xq23	HTR2C	5-hydroxytryptamine receptor 2C
Mouse	7	459	X 68.46 cM	Htr2c	5-hydroxytryptamine (serotonin) receptor 2C

RefSeq Protein

NP_036897 (Rn) , NP_000859 (Hs) , NP_032338 (Mm)

UniProtKB

P08909 (Rn) , P28335 (Hs) , P34968 (Mm)

OMIM

312861 (Hs)

RefSeq Nucleotide

NM_000868 (Hs) , NM_012765 (Rn) , NM_008312 (Mm)

Entrez Gene

3358 (Hs) , 25187 (Rn) , 15560 (Mm)

Ensembl Gene

ENSG00000147246 (Hs) , ENSMUSG00000041380 (Mm) , ENSRNOG00000030877 (Rn)

Protein GI

17298688 (Rn) , 160358831 (Mm) , 377520139 (Hs)

GPCRdb

5ht2c_human (Hs) , 5ht2c_mouse (Mm) , 5ht2c_rat (Rn)

UniProtKB ID/Entry name

5HT2C_HUMAN (Hs) , 5HT2C_MOUSE (Mm) , 5HT2C_RAT (Rn)

DrugBank Target

P28335 (Hs)

ChEMBL Target

CHEMBL225 (Hs) , CHEMBL3006 (Mm) , CHEMBL324 (Rn)

Target ID

11

名称

5-HT₆ receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	436	5q36	Htr6	5-hydroxytryptamine receptor 6
Human	7	440	1p36.13	HTR6	5-hydroxytryptamine receptor 6
Mouse	7	440	4 70.57 cM	Htr6	5-hydroxytryptamine (serotonin) receptor 6

RefSeq Protein

NP_077341 (Rn) , NP_000862 (Hs) , NP_067333 (Mm)

UniProtKB

P31388 (Rn) , P50406 (Hs) , Q9R1C8 (Mm)

OMIM

601109 (Hs)

RefSeq Nucleotide

NM_000871 (Hs) , NM_024365 (Rn) , NM_021358 (Mm)

Entrez Gene

3362 (Hs) , 64354 (Rn) , 15565 (Mm)

Ensembl Gene

ENSG00000158748 (Hs) , ENSMUSG00000028747 (Mm) , ENSRNOG00000049761 (Rn)

Protein GI

816197606 (Rn) , 10946684 (Mm) , 4504545 (Hs)

GPCRdb

5ht6r_human (Hs) , 5ht6r_mouse (Mm) , 5ht6r_rat (Rn)

UniProtKB ID/Entry name

5HT6R_HUMAN (Hs) , 5HT6R_MOUSE (Mm) , 5HT6R_RAT (Rn)

DrugBank Target

P50406 (Hs)

ChEMBL Target

CHEMBL1075268 (Mm) , CHEMBL3372 (Rn) , CHEMBL3371 (Hs)

Target ID

12

名称

5-HT₇ receptor

缩写名

SHP2

家族

5-Hydroxytryptamine receptors

别名

5-HT_1Dβ

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	448	1q53	Htr7	5-hydroxytryptamine receptor 7
Human	7	479	10q23.31	HTR7	5-hydroxytryptamine receptor 7
Mouse	7	448	19 30.3 cM	Htr7	5-hydroxytryptamine (serotonin) receptor 7

RefSeq Protein

NP_075227 (Rn) , NP_000863 (Hs) , NP_032341 (Mm)

UniProtKB

P32305 (Rn) , P34969 (Hs) , P32304 (Mm)

OMIM

182137 (Hs)

RefSeq Nucleotide

NM_000872 (Hs) , NM_022938 (Rn) , NM_008315 (Mm)

Entrez Gene

3363 (Hs) , 65032 (Rn) , 15566 (Mm)

Ensembl Gene

ENSG00000148680 (Hs) , ENSMUSG00000024798 (Mm) , ENSRNOG00000018827 (Rn)

Protein GI

113865998 (Mm) , 12621102 (Rn) , 10880131 (Hs)

GPCRdb

5ht7r_human (Hs) , 5ht7r_mouse (Mm) , 5ht7r_rat (Rn)

UniProtKB ID/Entry name

5HT7R_HUMAN (Hs) , 5HT7R_MOUSE (Mm) , 5HT7R_RAT (Rn)

DrugBank Target

P34969 (Hs)

ChEMBL Target

CHEMBL3155 (Hs) , CHEMBL3223 (Rn) , CHEMBL4764 (Mm)

Target ID

215

名称

D₂ receptor

缩写名

SHP2

家族

Dopamine receptors

别名

m5

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	444	8q23	Drd2	dopamine receptor D2
Human	7	443	11q23.2	DRD2	dopamine receptor D2
Mouse	7	444	9 26.72 cM	Drd2	dopamine receptor D2

RefSeq Protein

NP_036679 (Rn) , NP_000786 (Hs) , NP_034207 (Mm)

UniProtKB

P61169 (Rn) , P14416 (Hs) , P61168 (Mm)

OMIM

126450 (Hs)

RefSeq Nucleotide

NM_000795 (Hs) , NM_012547 (Rn) , NM_010077 (Mm)

Entrez Gene

1813 (Hs) , 24318 (Rn) , 13489 (Mm)

Ensembl Gene

ENSG00000149295 (Hs) , ENSMUSG00000032259 (Mm) , ENSRNOG00000008428 (Rn)

Orphanet

121177 (Hs)

Protein GI

6978777 (Rn) , 148747212 (Mm) , 17986270 (Hs)

GPCRdb

drd2_human (Hs) , drd2_mouse (Mm) , drd2_rat (Rn)

UniProtKB ID/Entry name

DRD2_HUMAN (Hs) , DRD2_MOUSE (Mm) , DRD2_RAT (Rn)

DrugBank Target

P14416 (Hs)

ChEMBL Target

CHEMBL217 (Hs) , CHEMBL3427 (Mm) , CHEMBL339 (Rn)

Target ID

217

名称

D₄ receptor

缩写名

SHP2

家族

Dopamine receptors

别名

m5

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	387	1q41	Drd4	dopamine receptor D4
Human	7	419	11p15.5	DRD4	dopamine receptor D4
Mouse	7	387	7 86.6 cM	Drd4	dopamine receptor D4

RefSeq Protein

NP_037076 (Rn) , NP_000788 (Hs) , NP_031904 (Mm)

UniProtKB

P30729 (Rn) , P21917 (Hs) , P51436 (Mm)

OMIM

126452 (Hs)

RefSeq Nucleotide

NM_000797 (Hs) , NM_012944 (Rn) , NM_007878 (Mm)

Entrez Gene

1815 (Hs) , 25432 (Rn) , 13491 (Mm)

Ensembl Gene

ENSG00000069696 (Hs) , ENSMUSG00000025496 (Mm) , ENSRNOG00000017927 (Rn)

Protein GI

6978779 (Rn) , 32483397 (Hs) , 6681223 (Mm)

GPCRdb

drd4_human (Hs) , drd4_mouse (Mm) , drd4_rat (Rn)

UniProtKB ID/Entry name

DRD4_HUMAN (Hs) , DRD4_MOUSE (Mm) , DRD4_RAT (Rn)

DrugBank Target

P21917 (Hs)

ChEMBL Target

CHEMBL219 (Hs) , CHEMBL2574 (Mm) , CHEMBL3361 (Rn)

Target ID

262

名称

H₁ receptor

缩写名

SHP2

家族

Histamine receptors

别名

α₂-C2

基因和蛋白信息

Species	Transmembrane Domains	Amino Acids	Chromosomal Location	Gene Symbol	Gene Name
Rat	7	486	4q42	Hrh1	histamine receptor H 1
Human	7	487	3p25.3	HRH1	histamine receptor H1
Mouse	7	488	6 53.05 cM	Hrh1	histamine receptor H1

RefSeq Protein

NP_058714 (Rn) , NP_000852 (Hs) , NP_032311 (Mm)

UniProtKB

P31390 (Rn) , P35367 (Hs) , P70174 (Mm)

OMIM

600167 (Hs)

RefSeq Nucleotide

NM_000861 (Hs) , NM_017018 (Rn) , NM_008285 (Mm)

Entrez Gene

3269 (Hs) , 24448 (Rn) , 15465 (Mm)

Ensembl Gene

ENSG00000196639 (Hs) , ENSMUSG00000053004 (Mm) , ENSRNOG00000007420 (Rn)

Protein GI

8393564 (Rn) , 358001084 (Mm) , 149158709 (Hs)

GPCRdb

hrh1_human (Hs) , hrh1_mouse (Mm) , hrh1_rat (Rn)

UniProtKB ID/Entry name

HRH1_HUMAN (Hs) , HRH1_MOUSE (Mm) , HRH1_RAT (Rn)

DrugBank Target

P35367 (Hs)

ChEMBL Target

CHEMBL4322 (Mm) , CHEMBL4701 (Rn) , CHEMBL231 (Hs)

关联配体

Ligand ID	34
名称	aripiprazole
别名	OPC 14597
类别	Synthetic organic
学名	7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}-1,2,3,4-tetrahydroquinolin-2-one
生物活性评价	The sulfonamide class of antibacterial compounds are primarily bacteriostatic agents and have a broad spectrum of activity against both Gram-positive and Gram-negative species of bacteria (reviewed in ).
评价	Aripiprazole is an atypical antipsychotic.

参考文献

1. Raedler LA. (2016) Aripiprazole Lauroxil (Aristada): Long-Acting Atypical Antipsychotic Injection Approved for the Treatment of Patients with Schizophrenia.. Am Health Drug Benefits, 9 (Spec Feature): (40-3). [PMID:27668044]
2. Aggarwal A, Gopalakrishna G, Lauriello J. (2016) Aripiprazole Lauroxil Long-Acting Injectable: The Latest Addition to Second-Generation Long-Acting Agents.. Clin Schizophr Relat Psychoses, 10 (1): (58-63). [PMID:27074333]
3. Rohde M, M Rk N, H?kansson AE, Jensen KG, Pedersen H, Dige T, J Rgensen EB, Holm R. (2014) Biological conversion of?aripiprazole lauroxil - An N-acyloxymethyl aripiprazole prodrug.. Results Pharma Sci, 4 (13): (19-25). [PMID:25756003]

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阿立哌唑

库存信息

库存信息

库存信息

库存信息

基本描述

名称和标识符

数据库链接

化学和物理性质

安全信息

靶标

关联配体

参考文献

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数据库链接

化学和物理性质

安全信息

靶标

关联配体

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相关文档

质检报告COA

产品问答

产品问答

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