CÁC TRA CỨU

HOÁ HỌC TIỆN ÍCH

Nguyễn Minh Chơn

3-2008
Chương trình ChemDraw, ChemWind

- Vẽ công thức
- Periodic table
- Thư viện lưu
- Biết tên gọi được cấu trúc (Tên theo IUPAC)
- Chưa đầy đủ
 BIOCHEMICAL NOMENCLATURE
COMMITTEES

INTERNATIONAL UNION OF PURE AND APPLIED

CHEMISTRY (IUPAC)
and
INTERNATIONAL UNION OF BIOCHEMISTRY AND
MOLECULAR BIOLOGY
IUPAC-IUBMB Joint Commission on Biochemical Nomenclature
(JCBN)
Nomenclature Committee of the International Union of
Biochemistry and Molecular Biology (NC-IUBMB)
http://www.chem.qmul.ac.uk/iupac/jcbn/
 Recommendation URL
Amino Acids and Peptides http://www.chem.qmul.ac.uk/iupac/AminoAcid/
Biochemical thermodynamics http://www.chem.qmul.ac.uk/iubmb/thermod/
Branched nucleic acids http://www.chem.qmul.ac.uk/iubmb/misc/bran.html
Carbohydrates http://www.chem.qmul.ac.uk/iupac/2carb/
Carotenoids http://www.chem.qmul.ac.uk/iupac/carot/
Corrinoids (vitamin B12) http://www.chem.qmul.ac.uk/iupac/misc/B12.html
Cyclitols http://www.chem.qmul.ac.uk/iupac/cyclitol/
Electron transport proteins http://www.chem.qmul.ac.uk/iubmb/etp/
Enzyme kinetics http://www.chem.qmul.ac.uk/iubmb/kinetics/
Enzyme nomenclature http://www.chem.qmul.ac.uk/iubmb/enzyme/
EC 1 Oxidoreductases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC1/
EC 2 Transferases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC2/
EC 3 Hydrolases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC3/
EC 4 Lyases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC4/
EC 5 Isomerases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC5/
EC 6 Ligases http://www.chem.qmul.ac.uk/iubmb/enzyme/EC6/
Folic acid http://www.chem.qmul.ac.uk/iupac/misc/folic.html
Glycolipids http://www.chem.qmul.ac.uk/iupac/misc/glylp.html
Glycoproteins http://www.chem.qmul.ac.uk/iupac/misc/glycp.html
myo-Inositol numbering http://www.chem.qmul.ac.uk/iupac/cyclitol/myo.html
Lignan Nomenclature http://www.chem.qmul.ac.uk/iupac/lignan/
Lipid Nomenclature http://www.chem.qmul.ac.uk/iupac/lipid/
Membrane transport proteins
Multienzymes
Multiple forms of enzymes
Nucleic acid constituents
Nucleic acid sequence
(incompletely specified bases)
Peptide hormones
Phosphorus containing
compounds
http://www.chem.qmul.ac.uk/iubmb/mtp/
http://www.chem.qmul.ac.uk/iubmb/misc/menz.html
http://www.chem.qmul.ac.uk/iubmb/misc/isoen.html
http://www.chem.qmul.ac.uk/iupac/misc/naabb.html
http://www.chem.qmul.ac.uk/iubmb/misc/naseq.html
http://www.chem.qmul.ac.uk/iubmb/misc/phorm.html
http://www.chem.qmul.ac.uk/iupac/misc/phospho.html
Polymerized amino acids
Polypeptide conformation
Polynucleotide conformation
Polysaccharide conformation
Prenol nomenclature
Pyridoxal (vitamin B6)
Quinones with an Isoprenoid
Chain
http://www.chem.qmul.ac.uk/iupac/misc/polypep.html
http://www.chem.qmul.ac.uk/iupac/misc/ppep1.html
http://www.chem.qmul.ac.uk/iupac/misc/pnuc1.html
http://www.chem.qmul.ac.uk/iupac/misc/psac.html
http://www.chem.qmul.ac.uk/iupac/misc/prenol.html
http://www.chem.qmul.ac.uk/iupac/misc/B6.html
http://www.chem.qmul.ac.uk/iupac/misc/quinone.html
Retinoids http://www.chem.qmul.ac.uk/iupac/misc/ret.html
Steroids http://www.chem.qmul.ac.uk/iupac/steroid/
Tetrapyrroles http://www.chem.qmul.ac.uk/iupac/tetrapyrrole/
Tocopherols (vitamin E) http://www.chem.qmul.ac.uk/iupac/misc/toc.html
Translation Factors http://www.chem.qmul.ac.uk/iubmb/misc/trans.html
Vitamin D http://www.chem.qmul.ac.uk/iupac/misc/D.html
 Chemical recommendations of use to biochemists
Bioinorganic glossary www.chem.qmul.ac.uk/iupac/bioinorg/
Class names www.chem.qmul.ac.uk/iupac/class/
Gold Book - chemical glossary www.chem.qmul.ac.uk/iupac/bibliog/gold.html
Isotopic modification www.chem.qmul.ac.uk/iupac/sectionH/
Medicinal chemistry glossary www.chem.qmul.ac.uk/iupac/medchem/
Natural product nomenclature www.chem.qmul.ac.uk/iupac/sectionF/
Physical organic chemistry glossary www.chem.qmul.ac.uk/iupac/gtpoc/
Stereochemical terminology www.chem.qmul.ac.uk/iupac/stereo/
Part 1, Section C: Peptide Nomenclature
Part 2, SYMBOLISM
Part 2, Section A: The Three-Letter System
Part 2, Section B: The One-Letter System
 Trivial
Symbolsb Systematic namec Formula
namea
Alanine Ala A 2-Aminopropanoic acid CH3-CH(NH2)-COOH
2-Amino-5-guanidinopentanoic H2N-C(=NH)-NH-[CH2]3-
Arginine Arg R
acid CH(NH2)-COOH
2-Amino-3-carbamoylpropanoic
Asparagine Asnd Nd H2N-CO-CH2-CH(NH2)-COOH
acid
2-Aminobutanedioic
Aspartic acid Aspd Dd HOOC-CH2-CH(NH2)-COOH
acid
2-Amino-3-mercaptopropanoic
Cysteine Cys C HS-CH2-CH(NH2)-COOH
acid
2-Amino-4-carbamoylbutanoic
Glutamine Glnd Qd H2N-CO-[CH2]2-CH(NH2)-COOH
acid
Glutamic
Glud E d 2-Aminopentanedioic acid HOOC-[CH2]2-CH(NH2)-COOH
acid
Glycine Gly G Aminoethanoic acid CH2(NH2)-COOH
2-Amino-3-(1H-imidazol-4-yl)-
Histidine His H
propanoic acid
2-Amino-3-methylpentanoic
Isoleucine Ile I C2H5-CH(CH3)-CH(NH2)-COOH
acide
2-Amino-4-methylpentanoic
Leucine Leu L (CH3)2CH-CH2-CH(NH2)-COOH
acid
Lysine Lys K 2,6-Diaminohexanoic acid H2N-[CH2]4-CH(NH2)-COOH
2-Amino-4-(methylthio)butanoic
Methionine Met M CH3-S-[CH2]2-CH(NH2)-COOH
acid
 2-Amino-3-phenylpropanoic
Phenylalanine Phe F C6H5-CH2-CH(NH2)-COOH
acid
Proline Pro P Pyrrolidine-2-carboxylic acid

2-Amino-3-hydroxypropanoic
Serine Ser S HO-CH2-CH(NH2)-COOH
acid
2-Amino-3-hydroxybutanoic
Threonine Thr T CH3-CH(OH)-CH(NH2)-COOH
acid e

2-Amino-3-(lH-indol-3-yl)-
Tryptophan Trp W
propanoic acid
2-Amino-3-(4-hydroxyphenyl)-
Tyrosine Tyr Y
propanoic acid
2-Amino-3-methylbutanoic
Valine Val V (CH3)2CH-CH(NH2)-COOH
acid
Unspecified amino
Xaa Xf
acid
 GLOSSARY OF CLASS NAMES
OF ORGANIC COMPOUNDS
AND REACTIVE INTERMEDIATES
BASED ON STRUCTURE

http://www.chem.qmul.ac.uk/iupac/class/

As well as an Introduction all class names

included are listed alphabetically in the following
files: A; B; C; D,E; F,G; H; I; K,L; M; N; O; P; Q,R;
S; T; U-Z.
 Carbohydrates
(and cyclitols)

Quick move to entries starting with the letters C, D, E, F, G, I, K, L, M, O, P, R, S, or U

saccharides:

The monosaccharides and di-, oligo-, and polysaccharides, which are made up of n
monosaccharide units linked to each other by a glycosidic bond. Considered by some to
be synonymous with carbohydrates.

sugars:

A loose term applied to monosaccharides and lower oligosaccharides. 2-Carb-1.1.

ulosonic acids: See ketoaldonic acids.

uronic acids:*

Monocarboxylic acids formally derived by oxidation to a carboxy group of the terminal -

CH2OH group of aldoses. 2-Carb-1.11 (p. 188). E.g. D-

glucuronic acid
 Terpenoids
(including retinoids and steroids)

Quick move to entries starting with the letters D, I , M, P, R, S , T, or X

carotenes:

Hydrocarbon carotenoids (a subclass of tetraterpenes). See also terpenes. See under

carotenoids.

carotenoids:
http://www.chem.qmul.ac.uk/iupac/class/
LIÊN KẾT
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E.C: Enzyme Classification, (Commission)
PDB: Protein Data Bank
CAS-RN
The Chemical Abstracts Service Registration
Numbers (CAS-RN)
ACX (Available Chemicals Xchange) Number
 Carcinogen
http://www.scorecard.org/health-effects/explanation.tcl?short_hazard_name=cancer

HEALTH EFFECTS|CARCINOGENS

Hàng trăm loại hoá chất có khả năng gây ung thư
cho người và động vật khi tiếp xúc lâu hoặc kéo dài
- Hiện nay biết 1233 hoá chất có khả năng gây ung
thư (kể cả dẫn xuất và đồng phân)
CARCINOGENS
Hundreds of chemicals are capable of inducing cancer in humans or animals after prolonged or excessive exposure. There are many well-
known examples of chemicals that can cause cancer in humans. The fumes of the metals cadmium, nickel, and chromium are known to
cause lung cancer. Vinyl chloride causes liver sarcomas. Exposure to arsenic increases the risk of skin and lung cancer. Leukemia can
result from chemically induced changes in bone marrow from exposure to benzene and cyclophosphamide, among other toxicants. Other
chemicals, including benzo[a]pyrene and ethylene dibromide, are considered by authoritative scientific organizations to be probably
carcinogenic in humans because they are potent carcinogens in animals. Chemically-induced cancer generally develops many years after
exposure to a toxic agent. A latency period of as much as thirty years has been observed between exposure to asbestos, for example, and
incidence of lung cancer.

More
References used to compile the list of carcinogens
List of recognized carcinogens
List of suspected carcinogens
acrylamide
aflatoxins
aldrin
aniline
benzene and its derivative compounds
captan
chloroform
chlorophenols
chlorophenoxy herbicides
cholesterol
DDT
ethylene thiourea
hydrazine
lead and lead compounds
saccharin
testosterone and its esters
thiourea
toluene diisocyanate
trichlorophenol, 2,4,6-
BENOMYL
CARBENDAZIM
COBALT COMPOUNDS
 H
Cl C Cl

CCl3

DDT (Dichlordiphenyl Trichlorethane)

Cl

Cl H2N

Cl
Aniline
Chloroform benzen
 O

NH2
acrylamide

NH2 H
H2C N
C S
H2 N
H2C N
H
S
Thiourea Ethylene thiourea
phenolphthalein

Type: HIn + H2O In- + H3O+

pK: 9.5
Approximate pH range for color change: 8.0-9.8
Color of acid form: clear
Color of base form: red-violet

PHENOLPHTHALEIN
THAY LỜI KẾT
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-Dễ trình bày công thức bằng hoá học
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- Chú ý tính an toàn trong sử dụng hoá
chất với từ khoá CARCINOGEN
Làm việc, Sức Khoẻ
và An Toàn