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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C=C1CC[C@H]2O[C@]2(C)CC[C@@H]2[C@@H]1CC2(C)C -
N-[3-[6-[[(1S)-1- (hydroxymethyl)- 2-methyl- propyl]amino] imidazo[1,2- b]pyridazin-3- yl]phenyl] acetamide PubChem CID 6419801
CC(=O)Nc1cccc(-c2cnc3ccc(N[C@H](CO)C(C)C)nn23)c1 -
Gadolinate(2-), (4-carboxy-5,8,11-tris(carboxymethyl)-1-phenyl-2-oxa-5,8,11-triazatridecan-13-oato(5-)-N(sup 5),N(sup 8),N(sup 11),O(sup 4),O(sup 5),O(sup 8),O(sup 11),O(sup 13))-, dihydrogen, comp. with 1-deoxy-1-(methylamino)-D-glucitol (1:2) CAS 127000-20-8 PubChem CID 6918204
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C([O-])CN(CCN(CC(=O)[O-])CC(=O)O)CCN(CC(=O)O)C(COCc1ccccc1)C(=O)[O-].[Gd+3] -
(4R)-4-Amino-2-(3-methoxypropyl)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-thieno[3,2-e][1,2]thiazine-6-sulfonamide CAS 404034-55-5 PubChem CID 10021113
COCCCN1C[C@H](N)c2cc(S(N)(=O)=O)sc2S1(=O)=O -
3-[6-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-benzoimidazol-1-yl]-propan-1-ol CAS 705263-43-0 PubChem CID 10361101
OCCCn1cnc2ccc(-c3c(-c4ccccn4)nn4c3CCC4)cc21 -
2(10H)-Phenazinone, 10-(4-chlorophenyl)-3-[(4-chlorophenyl)amino]- CAS 90712-89-3 PubChem CID 10410522
O=c1cc2n(-c3ccc(Cl)cc3)c3ccccc3nc-2cc1Nc1ccc(Cl)cc1 -
1H-Indole, 5-bromo-3-[(1-methyl-2-pyrrolidinyl)methyl]-, (R)-; (R)-5-Bromo-3-(N-methylpyrrolidin-2-ylmethyl)-1H-indole; 5-Bromo-3-[((2R)-1-methylpyrrolidin-2-yl)methyl]-1H-indole CAS 143322-57-0 PubChem CID 11185464
CN1CCC[C@@H]1Cc1c[nH]c2ccc(Br)cc12 -
[(2R)-1-[(2S)-2-Amino-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-boronic Acid Methanesulfonate; B-?[(2R)?-?1-?[(2S)?-?2-?amino-?3-?methyl-?1-?oxobutyl]?-?2-?pyrrolidinyl]?-?boronic Acid Methanesulfonate; CAS 150080-09-4 PubChem CID 11522448
CC(C)[C@H](N)C(=O)N1CCC[C@H]1B(O)O.CS(=O)(=O)O -
(2S)-2-azaniumyl-5-{[ammonio(imino)methyl]amino}pentanoate (2S,4S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]-4-(phenylsulfanyl)pyrrolidine-2-carboxylate CAS 81872-09-5 PubChem CID 11954366
C[C@H](CS)C(=O)N1C[C@@H](Sc2ccccc2)C[C@H]1C(=O)O.NC(N)=NCCC[C@H](N)C(=O)O -
(4R,13R)-7-hydroperoxy-44,64,74,83,93,103,114,134-hexaoxino[6,5-a]pentaoxola[2,3-d]hexaoxane-4,13-diol compound with hydrogen peroxide (1:1) CAS 101389-63-3 PubChem CID 13506617
CCCN(CCC)CCc1ccc(OC)c2[nH]c(=O)[nH]c12 -
[S-(R*,R*)]-alpha-Amino-beta-methyl-beta-sulfino-1H-1,2,3-triazole-1-butanoic Acid CAS 118175-11-4 PubChem CID 14151350
CC(Cn1ccnn1)(C(N)C(=O)O)S(=O)O -
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C.CC[C@H](C)[C@H](NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C -
7-methyl-6-(phenylmethoxy)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one PubChem CID 16739288
Cc1cc2[nH]c3c(c2cc1OCc1ccccc1)CCNC3=O -
Thieno[3,2-c]pyridine-5(4H)-acetic acid, alpha-(2-chlorophenyl)-6,7-dihydro-, methyl ester, hydrochloride (1:1) CAS 130209-90-4 PubChem CID 22386150
COC(=O)C(c1ccccc1Cl)N1CCc2sccc2C1.Cl -
N-[3-[1-[(4-fluorophenyl)methyl]-4-hydroxy-2-oxo-pyrrolo[1,2-b]pyridazin-3-yl]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]methanesulfonamide PubChem CID 24858075
CS(=O)(=O)Nc1ccc2c(c1)S(=O)(=O)N/C(=c1\c(=O)c3cccn3n(Cc3ccc(F)cc3)c1=O)N2 -
6-methyl-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide (S)-3-amino-4-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-4-oxobutanoate CAS 106372-55-8 PubChem CID 25130065
CC1=CC(=O)NS(=O)(=O)O1.COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(=O)O -
3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-bis(diazonium) dichloride, compound with zinc chloride CAS 84633-94-3 PubChem CID 44148500
COc1cc(-c2ccc([N+]#N)c(OC)c2)ccc1[N+]#N.Cl[Zn-2](Cl)(Cl)Cl -
2-PIPERIDINECARBOXYLIC ACID, 1-(2-AMINO-5-((IMINO(NITROAMINO)METHYL)AMINO)-1-OXOPENTYL)-4-METHYL-, ETHYL ESTER, MONOHYDROCHLORIDE, (2R-(1(S*),2.ALPHA.,4.BETA.))- CAS 74874-08-1 PubChem CID 46780287
CCOC(=O)[C@H]1C[C@H](C)CCN1C(=O)[C@@H](N)CCCN=C(N)N[N+](=O)[O-].Cl -
2-PIPERIDINECARBOXYLIC ACID, 1-(2-AMINO-5-((IMINO(NITROAMINO)METHYL)AMINO)-1-OXOPENTYL)-4-METHYL-, ETHYL ESTER, (2R-(1(S*),2.ALPHA.,4.BETA.))- CAS 79672-38-1 PubChem CID 46780288
CCOC(=O)[C@H]1C[C@H](C)CCN1C(=O)[C@@H](N)CCCN=C(N)N[N+](=O)[O-] -
CC1(C)CCC(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(NC5CCC(N6CCOCC6)CC5)c([N+](=O)[O-])c4)c(Oc4cnc5[nH]ccc5c4)c3)CC2)=C(c2ccc(Cl)cc2)C1