Compound Search
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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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N'-[3,5-bis(trifluoromethyl)phenyl]-2-(2-chlorophenyl)-2-[(8aS)-hexa-hydropyrrolo[1,2-a]pyrazin-2(1H) PubChem CID 25125907
O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(c1ccccc1Cl)N1CCN2CCC[C@H]2C1 -
(2S,3R,4S,5R,6R)-2-((2R,3S,4R,5R,6S)-6-(6-((2R,3S,4S,5R,6S)-3,4-dihydroxy-6-(hydroxymethyl)-5-((2R,3S PubChem CID 44586986
OC[C@@H]1O[C@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](SCC#CC#CCS[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)O[C@H]2CO)[C@@H](O)[C@H](O)[C@@H]1O -
5,5 ,5 ,5 ,5 ,5 -Hexa-tert-butyl-1,1 :3 ,1 :3 , PubChem CID 45105183
CC(C)(C)c1ccc(O)c(-c2cc(C(C)(C)C)cc(-c3cc(C(C)(C)C)cc(-c4cc(C(C)(C)C)cc(-c5cc(C(C)(C)C)cc(-c6cc(C(C)(C)C)ccc6O)c5O)c4O)c3O)c2O)c1 -
1,3-dimethyl 2-[(2E)-1-phenyl-3-{[tris(propan-2-yl)silyl]oxy}hexa-2,4-dien-1-yl]-2-(prop-2-yn-1-yl)propanedioate PubChem CID 46855959
C#CCC(C(=O)OC)(C(=O)OC)C(/C=C(\C=C\C)O[Si](C(C)C)(C(C)C)C(C)C)c1ccccc1 -
N-(2-cyanoethyl)-N-(4-{N-[6-(N-{4-[N-(2-cyanoethyl)4-methylbenzenesulfonamido]but-2-yn-1-yl}4-methylbenzenesulfonamido PubChem CID 46867634
Cc1ccc(S(=O)(=O)N(CC#CC#CCN(CC#CCN(CCC#N)S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)CC#CCN(CCC#N)S(=O)(=O)c2ccc(C)cc2)cc1 -
(3R,4S)-4-[(1R)-1-hydroxy-2-phenylbuta-2,3-dien-1-yl]-1-{6-[(2S,3R)-2-[(1R)-1-hydroxy-2-phenylbuta-2,3 PubChem CID 51040663
C=C=C(c1ccccc1)[C@@H](O)[C@H]1[C@@H](OC)C(=O)N1CC#CC#CCN1C(=O)[C@H](OC)[C@@H]1[C@H](O)C(=C=C)c1ccccc1 -
[(E)-5-(4-Hydroxy-5-{(E)-2-methyl-4-[2-methyl-5-((1Z,4E)-1-methyl-hexa-1,4-dienyl)-tetrahydro-furan-2 CAS 96717-74-7 PubChem CID 54706352
C/C=C/C/C=C(/C)C1CCC(C)(/C=C/C(C)C(=O)c2c(O)cc(C(C)CC/C=C/NC(=O)OC)oc2=O)O1 -
3-{2-[(1r,4s)-2-azabicyclo[2.2.1]hept-5-en-2-yl]ethyl}-1-benzyl-3-[(1e,3e)-hexa-1,3-dien-1-yl]-1,3-dihydro PubChem CID 57374117
CCC=CC=CC1(CCN2C[C@@H]3C=C[C@H]2C3)C(=O)N(Cc2ccccc2)c2ccccc21 -
2-[(2E,4E)-5-(9,9-diethylfluoren-2-yl)-3,4-bis(ethenyl)hexa-2,4-dien-2-yl]-7-[4-(9,9-diethylfluoren-2 PubChem CID 59005091
C=CC(/C(C=C)=C(\C)c1ccc2c(c1)C(C)(C(F)(F)F)c1cc(-c3ccc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)cc3)ccc1-2)=C(/C)c1ccc2c(c1)C(CC)(CC)c1ccccc1-2 -
2,2',2'',2''',2'''',2'''''-(1,4,7,10,13,16-Hexaazacyclooctadecane-1,4,7,10,13,16-hexayl)hexa(ethan-1- CAS 95919-10-1 PubChem CID 71331174
OCCN1CCN(CCO)CCN(CCO)CCN(CCO)CCN(CCO)CCN(CCO)CC1 -
CC(C)(O)C#CC#CC1(C)CO1 -
(R)-2-(3-(hydroxymethyl)-4-(1-methyl-5-(5-(2-methyl-4-(oxetan-3-yl)piperazin-1-yl)pyridin-2-ylamino)- PubChem CID 71557446
C[C@@H]1CN(C2COC2)CCN1c1ccc(Nc2cc(-c3ccnc(N4CCn5c(cc6c5CCCC6)C4=O)c3CO)cn(C)c2=O)nc1 -
(2Z,4E)-3-chloro-2-[(E)-2-chloro-1-(2,4,5,7-tetrachloro-3-hydroxy-6-oxo-xanthen-9-yl)vinyl]-6-[[6-[(2S PubChem CID 71596402
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)C3C[C@@H](CO)N(C(=O)CCCCCNC(=O)/C=C/C(Cl)=C(C(=O)O)\C(=C\Cl)c4c5cc(Cl)c(=O)c(Cl)c-5oc5c(Cl)c(O)c(Cl)cc45)C3)O2)c(=O)[nH]c1=O -
2,2 ,2 ,2 ,2 ,2 -(Benzene-1,2,3,4,5,6-hexayl)hexa[5-(1-naphthyl PubChem CID 71615841
c1ccc2c(-c3ccc(-c4c(-c5ccc(-c6cccc7ccccc67)o5)c(-c5ccc(-c6cccc7ccccc67)o5)c(-c5ccc(-c6cccc7ccccc67)o5)c(-c5ccc(-c6cccc7ccccc67)o5)c4-c4ccc(-c5cccc6ccccc56)o4)o3)cccc2c1 -
tert-Butyl 3-(3-((1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl)oxy)-2,2-bis(((1,1,1,3,3,3-hexa-fluoro PubChem CID 71619040
CC(C)(C)OC(=O)CCOCC(COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)COC(C(F)(F)F)(C(F)(F)F)C(F)(F)F -
1-(prop-2-en-1-yl)-2-({6-[2-(prop-2-en-1-yl)phenoxy]hexa-2,4-diyn-1-yl}oxy)benzene PubChem CID 85945223
C=CCc1ccccc1OCC#CC#CCOc1ccccc1CC=C -
2-(3-chloropyridin-2-yl)-N-[(4E)-2-methyl-4-(methylcarbamoyl)hexa-2,4-dien-3-yl]-5-[[5-(trifluoromethyl PubChem CID 88562912
C/C=C(/C(=O)NC)C(NC(=O)c1cc(Cn2nnc(C(F)(F)F)n2)nn1-c1ncccc1Cl)=C(C)C -
(2S)-N-hexa-2,4-diynyl-N-[(2S,3R)-3-hydroxy-1-oxo-1-[(2S)-2-[[2-phenylethyl-(2,2,2-trifluoroacetyl)amino PubChem CID 89839396
CC#CC#CCN(C(=O)[C@H](C)NC)[C@H](C(=O)N1CCC[C@H]1CN(CCc1ccccc1)C(=O)C(F)(F)F)[C@@H](C)O -
methyl (3R)-3-(5-{[(1S,4R,5R)-3-[(3R)-3-[(1R)-2-(acetyloxy)-1-(2-ethoxyethoxy)ethyl]hexa-1,5-diyn-1-yl PubChem CID 100916257
C#CC[C@H](C#CC1=C[C@H](Oc2ccc([C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)nc2Cl)[C@@H](O)[C@@]1(COC(C)=O)OCc1ccc(OC)cc1)[C@H](COC(C)=O)OCCOCC -
9-{6-[3,6-bis(2-dodecyl-1,3-dioxolan-2-yl)-9H-carbazol-9-yl]hexa-2,4-diyn-1-yl}-3,6-bis(2-dodecyl-1,3 PubChem CID 100920026
CCCCCCCCCCCCC1(c2ccc3c(c2)c2cc(C4(CCCCCCCCCCCC)OCCO4)ccc2n3CC#CC#CCn2c3ccc(C4(CCCCCCCCCCCC)OCCO4)cc3c3cc(C4(CCCCCCCCCCCC)OCCO4)ccc32)OCCO1