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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chloro-phenyl ester 12-(2-{1-[3-(3-methyl-indol-1-yl)-propyl]-1H-indol-3-yl}-acetylamino)-dodecyl ester; compound PubChem CID 9918266
Cc1cn(CCCn2cc(CC(=O)NCCCCCCCCCCCCOP(=O)(O)Oc3ccccc3Cl)c3ccccc32)c2ccccc12 -
Biphenylsulfonylcarbamate compound PubChem CID 9918412
CCCCOC(=O)NS(=O)(=O)c1ccccc1-c1ccc(Cn2c(CCC)nc(CC)c2C(=O)OCc2ccccc2C(=O)c2ccccc2)c(F)c1 -
4-(aminomethyl)-1-Cyclohexene-1-carboxylic acid, USP Tranexamic Acid Related Compound C, (RS)-4-(aminomethyl CAS 330838-52-3 PubChem CID 9920436
NCC1CC=C(C(=O)O)CC1 -
,N,6-Trimethyl-2-(4-methylphenyl)-alpha-oxo-imidazo[1,2-a]pyridine-3-acetamide; Zolpidem Related Compound CAS 400038-68-8 PubChem CID 9923131
Cc1ccc(-c2nc3ccc(C)cn3c2C(=O)C(=O)N(C)C)cc1 -
A (EP); 9,11-Didehydroestriol; Estriol Related Compound A; Estriol Impurity A CAS 246021-20-5 PubChem CID 9925903
C[C@]12CC=C3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@@H]2O -
2-(1-Benzyl-piperidin-4-yl)-1-(4-fluoro-phenyl)-ethanone; compound with but-2-enedioic acid;0.25hydrate PubChem CID 9926747
O=C(CC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 -
3-[11-(3-Dimethylamino-propylidene)-6,11-dihydro-dibenzo[b,e]oxepin-2-yl]-acrylic acid; compound with PubChem CID 9928323
CN(C)CC/C=C1/c2ccccc2COc2ccc(/C=C/C(=O)O)cc21 -
dihydroxy-16-methyl-21-(1-oxopropoxy)pregna-1,4-diene-3,20-dione; Beclomethasone Dipropionate Related Compound CAS 69224-79-9 PubChem CID 9934186
CCC(=O)OCC(=O)[C@@]1(O)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@@]21C -
US9273014, Comparative Compound 47 PubChem CID 9936156
CCCC[C@H](C(N)=O)[C@@H](CC(C)C)C(=O)N[C@H]1N=C(c2ccc(Cl)cc2)c2ccccc2N(C)C1=O -
Docosanoic acid, compound with N- [3- (dimethylamino)propyl]docosamide (1:1) CAS 125804-04-8 PubChem CID 9940434
CCCCCCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C.CCCCCCCCCCCCCCCCCCCCCC(=O)O -
trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)chroman-4-one compound CAS 111804-73-0 PubChem CID 9941750
COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1O.COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O -
Compound 504 PubChem CID 9942080
CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)[C@H](OCC2O[C@@H](O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)[C@H]2O)OC(CO)[C@@H]1OP(=O)(O)O -
carboxamide; endo-N-9-Azabicyclo[3.3.1]non-3-yl-1-methyl-1H-indazole-3-carboxamide; Granisetron Related Compound CAS 160177-67-3 PubChem CID 9948205
Cn1nc(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3)c2ccccc21 -
oxepin-11(6H)-ylidene}-N,N-dimethylpropan-1-amine oxide; Olopatadine N-Oxide; Olopatadine Related Compound CAS 173174-07-7 PubChem CID 9950431
C[N+](C)([O-])CC/C=C1/c2ccccc2COc2ccc(CC(=O)O)cc21 -
B (EP); Celecoxib RC B (USP); Celecoxib Related Compound B; Celecoxib Impurity B CAS 331943-04-5 PubChem CID 9951856
Cc1ccc(-c2cc(C(F)(F)F)n(-c3ccc(S(N)(=O)=O)cc3)n2)cc1 -
((S)-1-Methyl-hexyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester; compound with (E)-but-2-enedioic PubChem CID 9951970
CCCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1 -
Benzoic acid, 4-amino-, butyl ester, compound with 2,4,6-trinitrophenol (2:1) CAS 577-48-0 PubChem CID 9960605
CCCCOC(=O)c1ccc(N)cc1.CCCCOC(=O)c1ccc(N)cc1.O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 -
methyl-piperazine-1-carbonyl)-5H,11H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10-carbonyl]-phenyl}-amide; compound PubChem CID 9961036
CN1CCN(C(=O)c2ccc3n2Cc2ccccc2N(C(=O)c2ccc(NC(=O)c4ccccc4-c4ccccc4)cc2Cl)C3)CC1 -
dihydro-[1,2,4]triazol-4-ylmethyl]-biphenyl-2-sulfonic acid (3-methyl-thiophene-2-carbonyl)-amide; compound CAS 147776-06-5 PubChem CID 9961192
CCCCc1nn(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2sccc2C)cc1 -
THIAZOL-2(1H)-YLIDENE)METHYL]-1-BUTENYL}NAPHTHO[1,2-D][1,3]THIAZOL-1-IUM-1-YL)-1-PROPANESULFONATE COMPOUND PubChem CID 9962197
CCC(/C=C1\Sc2ccc3ccccc3c2N1CCCS(=O)(=O)O)=C\c1sc2ccc3ccccc3c2[n+]1CCCS(=O)(=O)O.c1ccncc1