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FAD

FAD structure

CAS No:
146-14-5
Formula:
C27H33N9O15P2
Chemical Name:
FAD
Synonyms:
Riboflavin 5′-(trihydrogen diphosphate),P′→5′-ester with adenosine;Adenosine 5′-(trihydrogen pyrophosphate),5′→5′-ester with riboflavine;Riboflavine,5′-ester with adenosine 5′-diphosphate;Benzo[g]pteridine,riboflavin 5′-(trihydrogen diphosphate) deriv.;Adenine-riboflavine dinucleotide;FAD;Riboflavin 5′-adenosine diphosphate;Adenine-flavine dinucleotide;Flavine-adenine dinucleotide;Riboflavine-adenine dinucleotide;Flavine adenosine diphosphate;Adenine-flavin dinucleotide;Flavin-adenine dinucleotide;Riboflavin-adenine dinucleotide;Adenine-riboflavin dinucleotide;Flavinat;Flavitan;Fademin;NSC 112207;Flavin adenin dinucleotide;16426-55-4;887565-61-9
Categories:
Cosmetic Ingredient > Viscosity Controlling

Description

Flavin Adenin Dinucleotide is a redox cofactor, more specifically a prosthetic group of a protein, involved in several important enzymatic reactions in metabolism.

Solid

FAD is a flavin adenine dinucleotide in which the substituent at position 10 of the flavin nucleus is a 5'-adenosyldiphosphoribityl group. It has a role as a human metabolite, an Escherichia coli metabolite, a mouse metabolite, a prosthetic group and a cofactor. It is a vitamin B2 and a flavin adenine dinucleotide. It is a conjugate acid of a FAD(3-).|A condensation product of riboflavin and adenosine diphosphate. The coenzyme of various aerobic dehydrogenases, e.g., D-amino acid oxidase and L-amino acid oxidase. (Lehninger, Principles of Biochemistry, 1982, p972) Flavin adenine dinucleotide is approved for use in Japan under the trade name Adeflavin as an ophthalmic treatment for vitamin B2 deficiency.|A condensation product of riboflavin and adenosine diphosphate. The coenzyme of various aerobic dehydrogenases, e.g., D-amino acid oxidase and L-amino acid oxidase. (Lehninger, Principles of Biochemistry, 1982, p972)

FAD Basic Attributes

Molecular Weight：

785.55

Exact Mass：

785.55

EC Number：

282-733-8

UNII：

ZC44YTI8KK

DSSTox ID：

DTXSID4048307

HScode：

29349990

Characteristics

PSA：

356

XLogP3：

-2.93

Appearance：

orange powder

Density：

2.1±0.1 g/cm3

Refractive Index：

1.850

Water Solubility：

5 mg/mL

Storage Conditions：

−20°C

Collision Cross Section：

247.3 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|259.22 Å² [M-H]- [CCS Type: DT, Method: stepped-field]|249 Å² [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|250.3 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|238.7 Å² [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|256.2 Å² [M+Na-2H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

Safety Information

wgk germany：

safety instructions：

24/25

RTECS Number：

AU7470000

Stability/Shelf Life：

Stable. Incompatible with strong oxidizing agents.

Toxicity

Toxicity Summary：

Oral mouse LD50 > 7000 mg/kg. Intravenous mouse LD50 589 mg/kg.

Drug Information

Drug Indication：

Used to treat eye diseases caused by vitamin B2 deficiency, such as keratitis and blepharitis.

MeSH Entry Terms：

Dinucleotide, Flavin-Adenine

FAD Use and Manufacturing

Uses

Labelled Flavine Adenine xidase. Riboflavin kinase tumor necrosis factor receptor 1 NADPH oxidase.It is suitable for skin and mucosal diseases, neurological tinnitus, cerebral arteriosclerosis, intractable headache, liver cirrhosis, jaundice and other liver diseases, eye diseases, and retinal diseases. Temporary chest discomfort can be seen if the intravenous injection is too fast.

Manufacturing Info：

Riboflavin 5'-(trihydrogen diphosphate), P'.fwdarw.5'-ester with adenosine: ACTIVE

Computed Properties

Molecular Weight:785.5
XLogP3:-5
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:13
Exact Mass:785.15713538
Monoisotopic Mass:785.15713538
Topological Polar Surface Area:356
Heavy Atom Count:53
Complexity:1560
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 146-14-5

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Guide of FAD

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Use and Manufacturing
Computed Properties
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