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=C(CC12CC3CC(CC(C3)C1)C2)Nc1cccc2nc(NCCNCCO)ccc12 -
4-{5-[Bis(2-hydroxyethyl)amino]-1-methyl-1H-1,3-benzimidazol-2-yl}butanoic acid CAS 109882-30-6 PubChem CID 13755672
Cn1c(CCCC(=O)O)nc2cc(N(CCO)CCO)ccc21 -
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 -
(3As,4R,7S,9R,10R,11R,13R,15R,15Ar)-1-(4-(4-(3-Aminophenyl)-1H-1,2,3-Triazol-1-Yl)Butyl)-10-(((2S,3R,4S,6R)-4-(Dimethylamino)-3-Hydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy)-4-Ethyl-7-Fluoro-11-Methoxy-3A,7,9,11,13,15-Hexamethyloctahydro-1H-[1]Oxacyclotetradecino[4,3-D]Oxazole-2,6,8,14(7H,9H)-Tetraone CAS 760981-83-7 PubChem CID 25242512
CC[C@H]1OC(=O)[C@@](C)(F)C(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCCCn3cc(-c4cccc(N)c4)nn3)C(=O)O[C@]12C -
1-[(1R,2S,3aS,3bR,5aS,7S,8S,9aS,9bS,11aS)-1,7-dihydroxy-9a,11a-dimethyl-8-(piperidin-1-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-2-yl]-1-methylpiperidin-1-ium CAS 745736-02-1 PubChem CID 14029410
C[C@]12C[C@H](N3CCCCC3)[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)[C@@H]([N+]3(C)CCCCC3)C[C@@H]12 -
CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC -
[Co].[Co].[Co].[Co].[Co].[Sm] -
Acetic acid, 2-[1-(aminocarbonyl)-2-[(5-nitro-2-furanyl)methylene]hydrazinyl]-; Acetic acid, [(aminocarbonyl)[(5-nitro-2-furanyl)methylene]hydrazino]- (9CI); Hydantoic acid, 3-(5-nitrofurfurylideneamino)- (6CI); Nitrofurantoin Related Compound A (USP) CAS 63981-22-6 PubChem CID 3035067
NC(=O)N(CC(=O)O)N=Cc1ccc([N+](=O)[O-])o1 -
9-Octadecenoic acid (9Z)-, compd. with N,N-diethylethanamine (1:1) CAS 10103-17-0 PubChem CID 6441319
CCCCCCCC/C=C\CCCCCCCC(=O)O.CCN(CC)CC -
N-[tert-Butoxy(hydroxy)methylidene]-L-alanine--N-cyclohexylcyclohexanamine (1/1) CAS 16948-17-7 PubChem CID 44146705
C1CCC(NC2CCCCC2)CC1.C[C@H](NC(=O)OC(C)(C)C)C(=O)O -
2,4,6,8-Tetraoxa-5-phosphanonanedioic acid, 5-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, 1-ethyl 9-(1-methylethyl) ester, 5-oxide, (2E)-2-butenedioate (1:1) CAS 1422284-17-0 PubChem CID 156594382
CCOC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)OCOC(=O)OC(C)C.O=C(O)/C=C/C(=O)O -
c12c3c4c5c1c1c6c7c2c2c8c3c3c9c4c4c%10c5c5c1c1c6c6c%11c7c2c2c7c8c3c3c8c9c4c4c9c%10c5c5c1c1c6c6c%11c2c2c7c3c3c8c4c4c9c5c1c1c6c2c3c41 -
5-[(4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino]-2-[2-[4-[(4-anilino-6-methoxy-1,3,5-triazin-2-yl)amino]-2-sulfo-phenyl]ethenyl]benzenesulfonic acid; 2-(bis(2-hydroxyethyl)amino)ethanol CAS 61136-17-2 PubChem CID 57358312
COc1nc(Nc2ccccc2)nc(Nc2ccc(C=Cc3ccc(Nc4nc(Nc5ccccc5)nc(OC)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)n1.OCCN(CCO)CCO -
(2R,3S)-rel-3-Hydroxypyrrolidine-2-carboxylic acid compound with 2,2,2-trifluoroacetic acid (1:1) CAS 1788041-58-6 PubChem CID 91825861
O=C(O)C(F)(F)F.O=C(O)[C@@H]1NCC[C@@H]1O -
1-(17.BETA.-(ACETYLOXY)-2-(MORPHOLIN-4-YL)-3-OXO-5.ALPHA.-ANDROST-1-EN-16.BETA.-YL)-1-(PROP-2-ENYL)PYRROLIDINIUM CAS 942983-85-9 PubChem CID 129896736
C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5CC(=O)C(N6CCOCC6)=C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(C)=O)CCCC1 -
InChI=1/C18H18ClNOS/c1-20(2)9-10-21-16-11-13-5-3-4-6-17(13)22-18-8-7-14(19)12-15(16)18/h3-8,11-12H,9-10H2,1-2H3 CAS 26615-21-4 PubChem CID 5736
CN(C)CCOC1=Cc2ccccc2Sc2ccc(Cl)cc21 -
InChI=1/C38H80N/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h5-38H2,1-4H3/q+1 CAS 14357-21-2 PubChem CID 7880
CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC -
3,9-Dihydroxy-2,4,8,10-tetraoxa-3lambda~5~,9lambda~5~-diphosphaspiro[5.5]undecane-3,9-dione--1,3,5-triazine-2,4,6-triamine (1/2) CAS 70776-17-9 PubChem CID 155571
Nc1nc(N)nc(N)n1.Nc1nc(N)nc(N)n1.O=P1(O)OCC2(CO1)COP(=O)(O)OC2 -
N-cyclohexylcyclohexanamine; 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid CAS 16944-17-5 PubChem CID 270654
C1CCC(NC2CCCCC2)CC1.CC(C)C(NC(=O)OC(C)(C)C)C(=O)O -
InChI=1/C19H17NO2/c21-18-14-6-2-3-7-15(14)19(22)17-12-13(8-9-16(17)18)20-10-4-1-5-11-20/h2-3,6-9,12H,1,4-5,10-11H2 CAS 6345-74-0 PubChem CID 238958
O=C1c2ccccc2C(=O)c2cc(N3CCCCC3)ccc21