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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1-[3-ethenyl-5-(hex-1-en-1-yl)-2,2-bis(trifluoromethyl)pyrrolidin-1-yl]-2,2,2-trifluoroethan-1-one PubChem CID 177411226
C=CC1CC(/C=C\CCCC)N(C(=O)C(F)(F)F)C1(C(F)(F)F)C(F)(F)F -
2-(hept-2-yn-1-yl)-3-(hex-1-yn-1-yl)-5-[3-(octyloxy)prop-1-yn-1-yl]thiophene PubChem CID 177438512
CCCCC#CCc1sc(C#CCOCCCCCCCC)cc1C#CCCCC -
2-{5-[1-(5-carboxylatopentyl)-3,3-dimethyl-5-nitro-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl PubChem CID 177448541
C#CCCCC[N+]1=C(/C=C/C=C/C=C2\N(CCCCCC(=O)[O-])c3ccc([N+](=O)[O-])cc3C2(C)C)C(C)(C)c2cc([N+](=O)[O-])ccc21 -
1-(1-aminoethyl)-1-(carboxylatomethyl)-2-(hex-2-en-1-yl)-1H-imidazol-1-ium PubChem CID 177457868
CCC/C=C/CC1=NC=C[N+]1(CC(=O)[O-])C(C)N -
1-(1-aminoethyl)-1-(carboxylatomethyl)-2-(hex-5-en-1-yl)-1H-imidazol-1-ium PubChem CID 177491800
C=CCCCCC1=NC=C[N+]1(CC(=O)[O-])C(C)N -
1-(1-aminoethyl)-1-(carboxylatomethyl)-2-(hex-3-en-1-yl)-1H-imidazol-1-ium PubChem CID 177548956
CC/C=C/CCC1=NC=C[N+]1(CC(=O)[O-])C(C)N -
1-(1-aminoethyl)-1-(carboxylatomethyl)-2-(hex-4-en-1-yl)-1H-imidazol-1-ium PubChem CID 177603607
C/C=C/CCCC1=NC=C[N+]1(CC(=O)[O-])C(C)N -
5-(benzoyloxy)-1-[2-(3-methoxy-2-methylbut-1-en-1-yl)-1,3-oxazol-4-yl]hex-3-yn-1-yl (2R,4R,5S)-5-[(tert-butyldimethylsilyl PubChem CID 177616357
C=CCC1CC(OCc2ccc(OC)cc2)CC(C[C@H](O[Si](C)(C)C(C)(C)C)[C@H](C)C[C@@H](C)C(=O)OC(CC#CC(C)OC(=O)c2ccccc2)c2coc(/C=C(\C)C(C)OC)n2)O1 -
[1-(3-methylcyclobut-1-en-1-yl)hex-1-en-1-yl]benzene PubChem CID 177622641
CCCC/C=C(/C1=CC(C)C1)c1ccccc1 -
carbamoylpropanamido]-3-hydroxypropanamido]-4-methylpentanamido]-3-[4-(phosphooxy)phenyl]propanamido]-4-{[(1S)-1- PubChem CID 177624509
C#CCCCC(=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(OP(=O)=O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(C)C -
1-methyl-4-[1-(phenyltellanyl)-2-(prop-2-en-1-yl)hex-1-ene-1-sulfinyl]benzene PubChem CID 177634856
C=CC/C(CCCC)=C(/[Te]c1ccccc1)S(=O)c1ccc(C)cc1 -
(R)-5-((2S,3R)-1-(((R)-1-carboxy-2-(((Z)-6-carboxy-6-((S)-2,2-dimethylcyclopropane-1-carboxamido)hex- PubChem CID 177833355
C[C@@H](O)[C@@H](C(=O)N[C@@H](CSCCCC/C=C(\NC(=O)[C@H]1CC1(C)C)C(=O)O)C(=O)O)[C@H]1CC(SCCN=CN)=C(C(=O)O)N1 -
OCC#CCCC[NH+]1CCCCC1.[Cl-] -
(Z)-1-diazonio-6-[[(Z)-6-diazonio-1-hydroxy-5-oxido-1-oxohex-5-en-2-yl]amino]-6-oxo-5-(prop-2-enylamino CAS 1397-84-8 PubChem CID 121447
C=CCNC(CCC(=O)C=[N+]=[N-])C(=O)NC(CCC(=O)C=[N+]=[N-])C(=O)O -
(Z)-1-diazonio-6-[[(Z)-6-diazonio-1-hydroxy-5-oxido-1-oxohex-5-en-2-yl]amino]-6-oxo-5-(prop-2-enylamino CAS 1397-85-9 PubChem CID 121449
C=CCNC(CCC(=O)C=[N+]=[N-])C(=O)NC(CCC(=O)C=[N+]=[N-])C(=O)O.O -
beta-D-erythro-Hex-2-enopyranuronic acid, 1-(4-amino-5-(hydroxymethyl)-2-oxo-1(2H)-pyrimidinyl)-4-((5 CAS 108351-49-1 PubChem CID 163787
CC(C)CC(N)C(=O)NC(CCN(C)C(=N)N)CC(=O)NC1C=CC(n2cc(CO)c(N)nc2=O)OC1C(=O)O -
(1S,5R,7R)-3-[(3,4-dihydroxyphenyl)(hydroxy)methylidene]-6,6-dimethyl-1-[(2S)-5-methyl-2-(prop-1-en-2 CAS 78824-30-3 PubChem CID 174159
C=C(C)[C@@H](CC=C(C)C)C[C@@]12C[C@@H](CC=C(C)C)C(C)(C)[C@@](CC=C(C)C)(C(=O)C(=C(O)c3ccc(O)c(O)c3)C1=O)C2=O -
3-Hydroxy-N-[(2S)-1-{(2S)-2-[hydroxy(imino)methyl]pyrrolidin-1-yl}-3-(1H-imidazol-5-yl)-1-oxopropan-2 CAS 120083-46-7 PubChem CID 195325
NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)C12CC1CC(=O)N2 -
Benzamide, 4-((O-4-amino-2-((2-amino-1-oxopropyl)amino)-2,4,6-trideoxy-alpha-D-galactopyranosyl-(1-4) CAS 78213-55-5 PubChem CID 196077
C=C1OC(OC2C(CO)OC(Oc3ccc(C(=O)NCCCNCCCCN)cc3)C2O)C(O)C(OC2OC(CO)C(OC3OC(C)C(N)C(O)C3NC(=O)C(C)N)C(O)C2O)C1O -
Benzamide, 4-((O-4-amino-2-((2-amino-1-oxopropyl)amino)-2,4,6-trideoxy-alpha-D-galactopyranosyl-(1->4 CAS 78213-56-6 PubChem CID 197218
C=C1OC(OC2C(CO)OC(Oc3ccc(C(=O)NCCCNCCCCNCCCCN)cc3)C2O)C(O)C(OC2OC(CO)C(OC3OC(C)C(N)C(O)C3NC(=O)C(C)N)C(O)C2O)C1O