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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CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)CSc3ccncc3)[C@H]2SC1.CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)CSc3ccncc3)[C@H]2SC1.c1ccc(CNCCNCc2ccccc2)cc1 -
BENZALKONIUM CHLORIDE, ASPIRIN, IBUPROFEN, ISOPROPYL ALCOHOL, BENZOCAINE, SD ALCOHOL, BACITRACIN ZINC, NEOMYCIN SULFATE, POLYMYXIN B SULFATE, ACETAMINOPHEN, DIPHENHYDRAMINE CHLORIDE CAS 1641-93-6 PubChem CID 3014024
CCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1.[Cl-] -
Oleic acid compound with (2R,3R,4S)-2-((R)-1,2-dihydroxyethyl)tetrahydrofuran-3,4-diol (1 CAS 112-80-1 PubChem CID 445639
CCCCCCCC/C=C\CCCCCCCC(=O)O -
Cyclopropanamine, 2-phenyl-, hydrochloride, (1R,2R)-rel-2-propen-1-amine, 3-phenyl-, (2E)- CAS 4335-60-8 PubChem CID 6008559
NC/C=C/c1ccccc1 -
CCCCCCCCC(=O)O.OCCNCCO -
4-[2-(4-amino-piperidin-1-yl)-5- (3-fluoro-4-methoxy-phenyl)-1- methyl-6-oxo-1,6-dihydro- pyrimidin-4-yl]-2-fluoro- benzonitrile CAS 1821307-10-1 PubChem CID 118483201
COc1ccc(-c2c(-c3ccc(C#N)c(F)c3)nc(N3CCC(N)CC3)n(C)c2=O)cc1F -
ethanesulfonic acid compound with 8-(3-(2-chloro-10H-phenothiazin-10-yl)propyl)-8-azabicyclo[3.2.1]octan-3-ol (1:1) CAS 63907-10-8 PubChem CID 246378
CCS(=O)(=O)O.OC1CC2CCC(C1)N2CCCN1c2ccccc2Sc2ccc(Cl)cc21 -
N6-(2-Hydroxypropyl)adenine; 1-(9H-Purin-6-ylamino)-2-propanol; 1-(Purin-6-ylamino)-2-propanol CAS 16958-60-4 PubChem CID 3242795
CC(O)CNc1ncnc2nc[nH]c12 -
1,4-Benzodioxin-5-carboxylic acid,2,3-dihydro-2,3-bis[(phenylmethoxy)methyl]-, trans-, compd. withbenzenemethanamine (1:1)OTHER CA INDEX NAMES:Benzenemethanamine,trans-2,3-dihydro-2,3-bis[(phenylmethoxy)methyl]-1,4-benzodioxin-5-carboxylate CAS 10139-91-0 PubChem CID 10419324
N#CCCc1ccc(N)cc1 -
3-acetamido-2,4,6-triiodo-benzoate; (2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol CAS 22154-43-4 PubChem CID 21126676
CC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO -
4-[6-[4-[[[[4-(hydroxymethyl)phenyl]amino]carbonyl]amino]phenyl]-4-(4-morpholinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinecarboxylic acid, methyl ester CAS 1062172-60-4 PubChem CID 24936050
COC(=O)N1CCC(n2ncc3c(N4CCOCC4)nc(-c4ccc(NC(=O)Nc5ccc(CO)cc5)cc4)nc32)CC1 -
CC1(C)S[C@@H]2[C@H](NC(=O)COc3ccccc3)C(=O)N2[C@H]1C(=O)O.CN(C)[C@@H]1C(=O)C(C(=O)NCN2CCN(CCO)CC2)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)cccc4[C@@](C)(O)C3C[C@@H]12 -
24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0^{2,10}.0^{4,8}.0^{14,22}.0^{17,21}]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21),23-nonaen-24-ium CAS 2447-54-3 PubChem CID 5154
C[n+]1cc2c3c(ccc2c2ccc4cc5c(cc4c21)OCO5)OCO3 -
6-Oxa-2-azabicyclo(3.2.0)heptane-3,7-dione, 1-(1-hydroxy-2-methylpropyl)-4-methyl-, (1S-(1alpha(S*),4beta,5alpha))- CAS 155975-72-7 PubChem CID 188934
CC(C)C(O)C12NC(=O)[C@@H](C)[C@H]1OC2=O -
2-Hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one, analytical reference material CAS 4883-60-7 PubChem CID 551084
CC1=C(O)C(=O)CC(C)(C)C1 -
4-(2-{4-[(2S)-6-bromo-12,13-dichloro-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)-1-oxidopyridin-1-ium PubChem CID 10507119
O=C(Cc1cc[n+]([O-])cc1)N1CCN([C@H]2c3ccc(Cl)c(Cl)c3CCc3cc(Br)cnc32)CC1 -
1-[(R)-alpha-Methylbenzyl]-2,2-dimethyl-7-(2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridine-1-yl)-1,2-dihydroquinazoline-4(3H)-one CAS 1810742-60-9 PubChem CID 91933875
C[C@H](c1ccccc1)N1c2cc(-n3c(=O)[nH]c4ncccc43)ccc2C(=O)NC1(C)C -
Piperidine, 1-(2-(4-(3-(4-methoxyphenyl)-2H-1-benzopyran-2-yl)phenoxy)ethyl)- CAS 157173-60-9 PubChem CID 133028
COc1ccc(C2=Cc3ccccc3OC2c2ccc(OCCN3CCCCC3)cc2)cc1 -
4-Pyridinecarboxylic acid, 2-(sulfomethyl)hydrazide, compd. with (S-(R*,R*))-2,2'-(1,2-ethanediyldiimino)bis(1-butanol) (2:1) CAS 5408-60-6 PubChem CID 162044
CCC[C@@H](O)NCCN[C@@H](CC)CO.O=C(NNCS(=O)(=O)[O-])c1ccncc1 -
Chloro-(2-Dicyclohexylphosphino-2 inverted exclamation marka,6 inverted exclamation marka-diisopropoxy-1,1 inverted exclamation marka-biphenyl)[2-(2-aminoethyl)phenyl]palladium(II) - methyl-t-butyl ether adduct (RuPhos Precatalyst 1st Gen) CAS 1028206-60-1 PubChem CID 66572931
CC(C)Oc1cccc(OC(C)C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.COC(C)(C)C.Cl[Pd+].NCCc1[c-]cccc1