Dehydrogenase, Formate

HCID 168009894

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Basic information

CAS: 9028-85-7
Standard SMILES: CCCc1ccc2cc(C=C(C)C(=O)c3c(O)cc(C(C)CCC=CCC(=O)OC)oc3=O)oc2c1.CCCc1ccc2cc(C=C(C)C(=O)c3c(O)cc(C(C)CCC=CCC(=O)OC)oc3=O)sc2c1.CCOc1ccc(C=C(C)C(=O)c2c(O)cc(C(C)CCC=CCC(=O)OC)oc2=O)cc1.CCOc1ccc(C=C(C)C(=O)c2c(O)cc(C(C)CCC=CCC(=O)OC)oc2=O)s1.COC(=O)CC=CCCC(C)c1cc(O)c(C(=O)C(C)=Cc2cc(Br)c(CC(C)C)s2)c(=O)o1.COC(=O)CC=CCCC(C)c1cc(O)c(C(=O)C(C)=Cc2cc3ccc(CCC(C)C)cc3o2)c(=O)o1.COC(=O)CC=CCCC(C)c1cc(O)c(C(=O)C(C)=Cc2ccc(Oc3ccc(C)cc3)s2)c(=O)o1
InChIKey: MECJGSAIRDLPQG-UHFFFAOYSA-N
Molecular formula: C194H219BrO47S4
Average molar mass: 3,511 g/mol
Monoisotopic mass: 3,507.28129

Names & identifiers

Preferred name: Dehydrogenase, Formate
IUPAC: methyl 7-[5-[3-[4-bromo-5-(2-methylpropyl)thiophen-2-yl]-2-methylprop-2-enoyl]-4-hydroxy-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[5-[3-(4-ethoxyphenyl)-2-methylprop-2-enoyl]-4-hydroxy-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[5-[3-(5-ethoxythiophen-2-yl)-2-methylprop-2-enoyl]-4-hydroxy-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[4-hydroxy-5-[2-methyl-3-[6-(3-methylbutyl)-1-benzofuran-2-yl]prop-2-enoyl]-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[4-hydroxy-5-[2-methyl-3-[5-(4-methylphenoxy)thiophen-2-yl]prop-2-enoyl]-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[4-hydroxy-5-[2-methyl-3-(6-propyl-1-benzofuran-2-yl)prop-2-enoyl]-6-oxopyran-2-yl]oct-3-enoate;methyl 7-[4-hydroxy-5-[2-methyl-3-(6-propyl-1-benzothiophen-2-yl)prop-2-enoyl]-6-oxopyran-2-yl]oct-3-enoate
English name: EC 1.2.1.2
Molecular weight: 0

Names & synonyms

9028-85-7Formate dehydrogenaseDehydrogenase, formateRefChem:585646DTXSID3093866EINECS 232-844-2E.C. 1.2.1.2232-844-290463-51-7Formate Dehydrogenase from Candida boidiniiDehydrogenase, formate(nicotinamide adenine dinucleotide phosphate)FDH

Show more names

IFDHADHXCL274FALDHGSNORGSH-FDHHEL-S-60p

Database identifiers

CAS: 9028-85-7
PubChem CID: 168009894
EC Number: 232-844-2

Properties

Computed structural properties

Topological polar surface area: 796 Å²
Hydrogen bond donors: 7
Hydrogen bond acceptors: 51
Rotatable bonds: 85
Heavy atoms: 246
Formal charge: 0
Complexity: 6,460

Physicochemical properties

Density: 1.1 g/mL · 1.1 g/mL at 20 °C
storage temp.: 2 · 2-8°C
form: powder
color: clear brown
biological source: yeast (Candida boidini)
Water Solubility: 10 g/L · water: soluble 10g/L
Specific Activity: 5 · 5.0-15.0units/mg protein
EPA Substance Registry System: Dehydrogenase, formate (9028-85-7)
UNSPSC Code: 12352204 · 12352204
NACRES: 54 · NA.54
Symbol(GHS): 8 · GHS08
Signal word: Danger
Hazard statements: 334 · H334
Precautionary statements: 261 · P261-P284-P501
PPE: 95 · Eyeshields, Gloves, type N95 (US)
WGK Germany: 3 · 3
F: 10 · 10-21
TSCA: TSCA listed
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 1 · Resp. Sens. 1

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory Information · 2 items

XU - indicates a substance exempt from reporting under the Chemical Data Reporting Rule, (40 CFR 711).

Dehydrogenase, formate: Does not have an individual approval but may be used under an appropriate group standard

Safety data

F: 10-21
PPE: Eyeshields, Gloves, type N95 (US)
wgk: 3
tsca: TSCA listed
Signal word: Danger
Symbol(GHS): GHS08
Storage Class: 11 - Combustible Solids
Hazard statements: H334
Hazard Classifications: Resp. Sens. 1
Precautionary statements: P261-P284-P501

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationFormate dehydrogenase: ACTIVE

Applications · 3 items

UsesMost widely used in cofactor recycling systems for NADH.

UsesFormate Dehydrogenase (FDH) is used for diagnostics in large scale industrial processes. Its used in the production of an unnatural amino acid, tert-L-leucine, a component of some HIV protease and matrix metalloprotease inhibitors.

General DescriptionFormate:NAD+ oxidoreductaseFormate dehydrogenase is part of the D-specific 2-hydroxy acid superfamily of dehydrogenases. It is a dimer of two identical subunits. The enzyme has a cysteine residue which is essential for its activity or structural integrity.

Suppliers87 total

湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]

浙江自贸区宝星生物有限公司15801437065 18930316038 · [email protected]

湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

上海百泰欣生物有限公司13701899122 · [email protected]

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