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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O=C1Nc2c(F)cccc2C1=O -
COc1cn(C)c2ccccc2c1=O -
(8S,10S,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one CAS 10184-70-0 PubChem CID 625228
CC12CCC(=O)C=C1CCC1C2=CCC2(C)C1CCC2(O)C(=O)CO -
2 inverted exclamation marka,4,4 inverted exclamation marka-Trihydroxy-6 inverted exclamation marka-methoxy-3 inverted exclamation marka-prenylchalcone CAS 6754-58-1 PubChem CID 639665
COc1cc(O)c(CC=C(C)C)c(O)c1C(=O)/C=C/c1ccc(O)cc1 -
InChI=1/C19H23NO4/c1-12(2)9-10-24-15-7-5-14(6-8-15)17-16(11-13(3)4)18(21)20(23)19(17)22/h5-9,13,23H,10-11H2,1-4H CAS 656830-26-1 PubChem CID 641729
CC(C)=CCOc1ccc(C2=C(CC(C)C)C(=O)N(O)C2=O)cc1 -
5-Bromo-furan-2-carboxylic acid 4-nitro-phenyl ester PubChem CID 676825
O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccc(Br)o1 -
3-Thiophenecarbonitrile, 2-amino-5-methyl-; 2-Amino-5-methyl-3-thiophenecarbonitrile; 2-Amino-3-cyano-5-methylthiophene CAS 138564-58-6 PubChem CID 689056
Cc1cc(C#N)c(N)s1 -
N,N-diethyl[2-(2-furylcarbonylamino)(4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)] carboxamide PubChem CID 692940
CCN(CC)C(=O)c1c(NC(=O)c2ccco2)sc2c1CCCC2 -
COc1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 -
4,5-bis(chloranyl)-2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridazin-3-one CAS 303987-71-5 PubChem CID 900971
O=C(Cn1ncc(Cl)c(Cl)c1=O)c1ccc(Cl)cc1 -
(5E)-3-(furan-2-ylmethyl)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-2-phenylimino-1,3-thiazolidin-4-one PubChem CID 1208979
C=CCc1cc(/C=C2/SC(=Nc3ccccc3)N(Cc3ccco3)C2=O)cc(OC)c1O -
(2S)-6-bromo-2-(2-chlorophenyl)-3-nitro-2H-chromene PubChem CID 1296437
O=[N+]([O-])C1=Cc2cc(Br)ccc2O[C@H]1c1ccccc1Cl -
2-[2-hydroxy-2-oxoethyl-[3-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)propanoyl]amino]ethanoic acid CAS 858770-07-7 PubChem CID 1759677
COc1ccc2c(C)c(CCC(=O)N(CC(=O)O)CC(=O)O)c(=O)oc2c1 -
2-methoxy-1-{2-[4-(2-methoxyphenyl)piperazinyl]-6-(trifluoromethyl)pyrimidin-4 -yl}benzene CAS 686725-20-2 PubChem CID 1868436
COc1ccccc1-c1cc(C(F)(F)F)nc(N2CCN(c3ccccc3OC)CC2)n1 -
1-{[(4-tert-butylphenyl)amino]methyl}-2,3-dihydro-1H-indole-2,3-dione PubChem CID 2731902
CC(C)(C)c1ccc(NCN2C(=O)C(=O)c3ccccc32)cc1 -
4-oxo-6-(pyridin-3-yl)-9-thia-3-azatricyclo[8.4.0.0^{2,7}]tetradeca-1(10),2(7),5,11,13-pentaene-5-carbonitrile PubChem CID 2816444
N#Cc1c(-c2cccnc2)c2c([nH]c1=O)-c1ccccc1SC2 -
2-(1,3-benzothiazol-2-yl)-5-methyl-4-(3-methylbutyl)-2,4-dihydro-3H-pyrazol-3-one CAS 726201-05-4 PubChem CID 2981168
CC1=NN(c2nc3ccccc3s2)C(=O)C1CCC(C)C -
[(1S,3R,13S,14S,17S,18R,19R,20S,21S,23R,24R,25S)-18,19,21,24-tetrakis(acetyloxy)-25-hydroxy-3,13,14,25-tetramethyl-6,15,22-trioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7,9,11-trien-20-yl]methyl acetate CAS 33458-64-9 PubChem CID 3002217
CC(=O)OC[C@]12[C@H](OC(C)=O)C(=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)c1cccnc1[C@@H](C)[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@]4(C)O -
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O -
(2R,3R,4R,5S,6R)-6-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4,5-tetraol compound with propane-1,2,3-triol (1:1) CAS 9041-35-4 PubChem CID 3084046
OCC(O)CO.OC[C@H]1O[C@@H](O)[C@H](O)[C@H](O)[C@@H]1O