Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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Risperidone Related Compound HCl (3-(4-Piperidyl)-1,2-Benzisoxazole HCl) CAS 84163-68-8 PubChem CID 13076436
c1ccc2c(C3CCNCC3)noc2c1 -
(1RS)-1-[1-(4-Chlorophenyl)cyclobutyl]-N,3-dimethylbutan-1-amine Hydrochloride; Sibutramine Hydrochloride CAS 84467-94-7 PubChem CID 13083195
CNC(CC(C)C)C1(c2ccc(Cl)cc2)CCC1.Cl -
Acid Ethyl Ester; [1-Methyl-5-bis(2'-hydroxyethyl)aminobenzimidazolyl-2]butanoic Acid Ethyl Ester; 4- CAS 3543-74-6 PubChem CID 13086945
CCOC(=O)CCCc1nc2cc(N(CCO)CCO)ccc2n1C -
(S)-3-(1-(tert-butoxycarbonyl)-1H-imidazol-4-yl)-2-(tert-butoxycarbonylamino)propanoic acid compound CAS 388086-36-0 PubChem CID 13131481
CC(C)(C)OC(=O)NC(Cc1cn(C(=O)OC(C)(C)C)cn1)C(=O)O.c1ccccc1 -
Ibuprofen Related Compound (2,3-Dihydroxypropyl 2-(4-Isobutylphenyl)Propanoate) CAS 64622-21-5 PubChem CID 13175019
CC(C)Cc1ccc(C(C)C(=O)OCC(O)CO)cc1 -
Benazepril USP Related Compound E; [(3S)-3-Amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic CAS 88372-47-8 PubChem CID 13243495
N[C@H]1CCc2ccccc2N(CC(=O)O)C1=O -
Cc1ccc2cccc[n+]2c1.[I-] -
CC(C)c1ccc2cccc[n+]2c1.[I-] -
[3-(4-isopropoxyphenyl)cyclohexyl]acetic acid compound with cyclohexanamine (1:1) PubChem CID 13787757
CC(C)Oc1ccc(C2CCCC(CC(=O)O)C2)cc1.NC1CCCCC1 -
Esterified Compound Impurity B; 4-(2-amino-6-chloro-9H-purin-9-yl)-2-(hydroxymethyl)butyl acetate; 2- PubChem CID 13883187
CC(=O)OCC(CO)CCn1cnc2c(Cl)nc(N)nc21 -
N-((1-(1,1-Biphenyl)-4-ylisopropyl)oxycarbonyl)glycine, compound with N-dicyclohexylamine (1:1) CAS 18701-38-7 PubChem CID 14039210
C1CCC(NC2CCCCC2)CC1.CC(C)(OC(=O)NCC(=O)O)c1ccc(-c2ccccc2)cc1 -
1-(1-(1,1'-Biphenyl)-4-yl-1-methylethyl) hydrogen (S)-pyrrolidine-1,2-dicarboxylate, compound with dicyclohexylamine CAS 18725-28-5 PubChem CID 14039259
C1CCC(NC2CCCCC2)CC1.CC(C)(OC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1 -
Benzenediazonium, 2,5-dibutoxy-4-morpholino-, chloride, compound with zinc chloride CAS 32457-96-8 PubChem CID 14121518
CCCCOc1cc(N2CCOCC2)c(OCCCC)cc1[N+]#N.Cl[Zn]Cl.[Cl-] -
3-((2E)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3(2H)-yl)-1-propanesulfonic PubChem CID 14323590
CCN(CC)CC.CCN1C(=O)/C(=C2\Sc3ccccc3N2CCCS(=O)(=O)O)SC1=S -
2,3-Dihydro-4-methyl-2-[2-(2-methyl-1-pyrrolidinyl)ethyl]pyrido[3,2-f][1,4]oxazepine-5(4H)-thione fumarate PubChem CID 14391511
CC(C)O.CC1CCCN1CCC1CN(C)C(=S)c2cccnc2O1.O=C(O)/C=C/C(=O)O -
L-Glutamic acid, N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-, 5-methyl ester; Methotrexate CAS 67022-39-3 PubChem CID 14537265
COC(=O)CC[C@H](NC(=O)c1ccc(N(C)Cc2cnc3nc(N)nc(N)c3n2)cc1)C(=O)O -
N-Formyldesloratadine; 8-Chloro-6,11-dihydro-11-(N-formyl-4-piperidinylidene)-5H-benzo[5,6]cyclohepta CAS 117810-61-4 PubChem CID 14554138
O=CN1CCC(=C2c3ccc(Cl)cc3CCc3cccnc32)CC1 -
Orlistat Related Compound D (10 mg) (N-formyl-L-leucine (3S,4R,6S)-tetrahydro-3-hexyl-2-oxo-6-undecyl CAS 130793-27-0 PubChem CID 14607527
CCCCCCCCCCCC1CC(OC(=O)C(CC(C)C)NC=O)C(CCCCCC)C(=O)O1 -
US9161922, Table 4, Compound 2 PubChem CID 14831561
CCC=C=CCN -
9,10-Epoxy-3-hydroxy-1-oxatricyclo[4.4.0^2,9^.0^3,8^]dodecane compound (4) PubChem CID 14910845
O[C@]12CCCC[C@H]1[C@@]13O[C@@H]1CCO[C@@H]23