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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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Benzaldehyde, 3-hydroxy-; Benzaldehyde, m-hydroxy- (8CI); 3-Hydroxybenzaldehyde; 3-Formylphenol; 5-Hydroxybenzaldehyde; NSC 3504; m-Formylphenol; m-Hydroxybenzaldehyde CAS 100-83-4 PubChem CID 101

O=Cc1cccc(O)c1
Vigabatrin impurity D (EP); Gamma Aminobutyric Acid; 4-Aminobutanoic Acid; ?-Aminobutyric Acid; Butanoic acid, 4-amino-; Butyric acid, 4-amino- (7CI,8CI); 3-Carboxypropylamine; 4-Aminobutyric acid; Aminalon; GABA; Gaballon; Gamarex; Gammalon; Gammalone; Gammar; Gammasol; Mielogen; Mielomade; NSC 27418; NSC 32044; NSC 45460; NSC 51295; Oryza GABA Extract HC 90; Pharma-GABA 20S; Pharmagaba; Pharmagaba 20; Pharmagaba 20D; Piperidic acid; Piperidinic acid; ?-Aminobutanoic acid; ?-Aminobutyric acid; Sodium Alendronate Impurity A; Vigabatrin Impurity D CAS 56-12-2 PubChem CID 119

NCCCC(=O)O
4-Hydroxybenzaldehyde; Bisoprolol Fumarate Imp. S (EP); Bisoprolol Imp. S (EP); Bisoprolol Fumarate Impurity S; Bisoprolol Impurity S CAS 123-08-0 PubChem CID 126

O=Cc1ccc(O)cc1
InChI=1/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11 CAS 156-38-7 PubChem CID 127

O=C(O)Cc1ccc(O)cc1
4-Hydroxybenzoic Acid; Ethyl Parahydroxybenzoate Imp. A (EP); Butyl Parahydroxybenzoate Imp. A (EP); Propyl Parahydroxybenzoate Imp. A (EP); Methyl Parahydroxybenzoate Imp. A (EP); Acetylsalicylic Acid Imp. A (EP); Salicylic Acid Imp. A (EP); 4-Carboxyphenol; 4-Hydroxybenzoic acid; NSC 4961; Paraben-acid; p-Carboxyphenol; p-Hydroxybenzoic acid; p-Salicylic acid; Salicylic Acid USP Related Compound A; Salicylic Acid USP RC A; SKF-29685; CCI 23875; Ph Eur Salicylic Acid Impurity A; p-hydroxybenzoic acid; p-hydroxybenzoic acid; GW 466608X; GW 470921X; GW 403126X; GW 357662X; GW 444710X; Salicylic Acid Related Compound A; Acetylsalicylic Acid Impurity A; Butyl Parahydroxybenzoate Impurity A; Ethyl Parahydroxybenzoate Impurity A; Methyl Parahydroxybenzoate Impurity A; Propyl Parahydroxybenzoate Impurity A; Salicylic Acid Impurity A CAS 99-96-7 PubChem CID 135

O=C(O)c1ccc(O)cc1
Benfluorex Hydrochloride Imp. C (EP); Benfluorex Imp. C (EP); Glycopyrronium Bromide Imp. D (EP); Mefenamic Acid Imp. D (EP); Metronidazole Benzoate Imp. C (EP); Benzoic Acid; Benzenecarboxylic acid; Benzeneformic acid; Benzenemethanoic acid; Carboxybenzene; Dracylic acid; E 210; HA 1; HA 1 (acid); MENNO-Florades; NSC 149; Phenylcarboxylic acid; Phenylformic acid; Purox B; Retarder BA; Retardex; Salvo liquid; Solvo powder; Tenn-Plas; VevoVitall; BRL-9421A; Benfluorex Hydrochloride Impurity C; Benzoyl Peroxide Hydrous Impurity B; Glycopyrronium Bromide Impurity D; Mefenamic Acid Impurity D; Metronidazole Benzoate Impurity C; Benfluorex Impurity C; Glycopyrronium Impurity D CAS 65-85-0 PubChem CID 243

O=C(O)c1ccccc1
Formamide, N-(2-formylphenyl)- (9CI) CAS 25559-38-0 PubChem CID 400

O=CNc1ccccc1C=O
gamma-Oxo-3-pyridinebutanoic Acid 2,5-Dioxo-1-pyrrolidinyl Ester CAS 4192-31-8 PubChem CID 437

O=C(O)CCC(=O)c1cccnc1
Benzoic acid, 3-chloro-; Benzoic acid, m-chloro- (8CI); 3-Chlorobenzoic acid; NSC 8443; m-Chlorobenzoic acid; 3-Chlorobenzoic Acid; 433C58; Bupropion related; 3-chlorobenzoic acid (433C58) CAS 535-80-8 PubChem CID 447

O=C(O)c1cccc(Cl)c1
4-Nitrobenzaldehyde, for spectrophotometric det. of amino sugars, >=99.0% CAS 555-16-8 PubChem CID 541

O=Cc1ccc([N+](=O)[O-])cc1
(+/-)-2,3-Dihydroxy-propanal; (+/-)-Glyceraldehyde; 2,3-Dihydroxypropanal; 2,3-Dihydroxypropionaldehyde; DL-Glyceric aldehyde; Glyceraldehyde; Glyceric aldehyde; Glycerinaldehyde; Glycerose; NSC 67934; dl-Glyceraldehyde; alpha,beta-Dihydroxypropionaldehyde CAS 56-82-6 PubChem CID 751

O=CC(O)CO
1,2-Benzenediol, 4-[1-hydroxy-2-(methylamino)ethyl]-; 1,2-Benzenediol, 4-[1-hydroxy-2-(methylamino)ethyl]-, (+/-)-; Benzyl alcohol, 3,4-dihydroxy-a-[(methylamino)methyl]-, (+/-)- (8CI); (+/-)-Adrenaline; (+/-)-Epinephrine; 1-(3,4-Dihydroxy)phenyl-2-methylaminoethanol; 2-(Methylamino)-1-(3,4-dihydroxyphenyl)ethanol; DL-Adrenaline; Epirenamine; Racepinefrine; Racepinephrine; dl-Adrenaline; dl-Epinephrine; Dipivefrine Hydrochloride Impurity A; Dipivefrine Impurity A CAS 329-65-7 PubChem CID 838

CNCC(O)c1ccc(O)c(O)c1
Nickel, mesh, 130x130mm, nominal aperture 0.04mm, thickness 0.004mm, wire diameter 0.011mm, 500 wires/inch, open area 60%, electro-formed mesh, 99.9% CAS 7440-02-0 PubChem CID 935

[Ni]
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol CAS 57-50-1 PubChem CID 1115

OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O
Urea; AUS 32; AdBlue; Aquacare; Aquadrate; B-I-K; Basodexan; Benural 70; Carbamide; Carbamimidic acid; Carbonyl diamide; Carmol 40; Cellpaste K 4; Cellton NP; DEF; DEF (diesel exhaust fluid); Diesel exhaust fluid; Duration III; ESN; Elaqua XX; Eucerin 10% Urea Lotion; Hyanit; Isourea; Keratinamin; Keratinamin Kowa; Low Biuret Urea; NSC 34375; Nutraplus; Onychomal; Onyster; Optigen 1200; Optigen II; Pastaron; Pastaron 10; Pastaron 20; Pastaron 20 soft; Pastaron soft; Pseudourea; Rubinol ST 010; SGN 250; UR; Ultra Low Biuret Urea; Urea perhydrate; Ureaphil; Ureophil; Urepeal; Urepeal L; Urepearl; Urevert; Uria; Uroderm; Varioform II CAS 57-13-6 PubChem CID 1176

NC(N)=O
1,10-Phenanthroline in combination with isoniazid and rifampicin CAS 66-71-7 PubChem CID 1318

c1cnc2c(c1)ccc1cccnc12
1-Amino-1-cyclohexanecarboxylic acid hydrochloride CAS 2756-85-6 PubChem CID 1366

NC1(C(=O)O)CCCCC1
Dimethyl-{3-[5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridin-2-yloxy]-propyl}-amine CAS 95-00-1 PubChem CID 1485

NCc1ccc(Cl)cc1Cl
(2R,3S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol CAS 4291-63-8 PubChem CID 1546

Nc1nc(Cl)nc2c1ncn2C1CC(O)C(CO)O1
1H-Imidazol-4-ylmethanol; 4-(Hydroxymethyl)imidazole; 4-Imidazolylmethanol; 4-Methylol-1H-imidazole CAS 822-55-9 PubChem CID 1745

OCc1cnc[nH]1