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Validamycin structure, CAS 37248-47-8

Validamycin

CAS Number37248-47-8

Synonymsvalimon; Validamycin A; validamycin; Validamycin; SOLACOL; MYCIN; VALIDAMYCIN A; VALDIDAMYCIN; VALIDACIN; validomycin A

Molecular FormulaC20H35NO13

Molecular Weight497.49

Purity≥95 (HPLC)%

Density1.7±0.1 g/cm3

Boiling Point813.7±65.0 °C at 760 mmHg

Melting Point130-135ºC

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9012905 Purity: ≥95 (HPLC)%
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Quality Control of [ 37248-47-8 ] Purity: ≥95 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number37248-47-8
Catalog No.2A-9012905
Chinese Name井冈霉素
Synonymsvalimon; Validamycin A; validamycin; Validamycin; SOLACOL; MYCIN; VALIDAMYCIN A; VALDIDAMYCIN; VALIDACIN; validomycin A
Molecular FormulaC20H35NO13
Molecular Weight497.49
Purity≥95 (HPLC)
Density1.7±0.1 g/cm3
Boiling Point813.7±65.0 °C at 760 mmHg
Melting Point130-135ºC
Appearancepowder
Storage ConditionThe warehouse is ventilated and dried at low tempe
ApplicationValidamycin A is an aminoglycoside agricultural antibiotic. Validamycin A can inhibit the growth of Aspergillus flavus with an MIC value of 1 μg/mL. Validamycin A is a reversible tyrosinase inhibitor
MDL NumberMFCD09028089
SMILESOCC1=CC(NC2CC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C20H35NO13/c22-3-6-1-8(12(26)15(29)11(6)25)21-9-2-7(4-23)19(17(31)13(9)27)34-20-18(32)16(30)14(28)10(5-24)33-20/h1,7-32H,2-5H2/t7-,8+,9+,10-,11-,12+,13+,14-,15+,16+,17-,18-,19-,20+/m1/s1
InChI KeyJARYYMUOCXVXNK-CSLFJTBJSA-N
Hazard SymbolsTransport
MSDSmsds/12905_1_37248_47_8.pdf
BioactivityValidamycin A is an aminoglycoside agricultural antibiotic. Validamycin A inhibits the growth of A. flavus, with a MIC of 1 μg/mL[1]. Validamycin A is a reversible tyrosinase inhibitor, with a Ki of 5.893 mM[2]. Related Catalog Research Areas >> Infection Signaling Pathways >> Anti-infection >> Fungal Signaling Pathways >> Metabolic Enzyme/Protease >> Tyrosinase Target Ki: 5.893 mM (tyrosinase)[2] In Vitro Validamycin A (0.5-1 μg/mL; 18 hours) inhibits the growth of A. flavus and delayed conidial germination[1]. Validamycin A shows no cytotoxicity to human bronchial epithelial cells[1]. Validamycin A binds directly to several residues in the active site of tyrosinase, including HIS85, HIS244, GLU256, HIS259 and ASN260[1]. Cell Proliferation Assay[1] Cell Line: Aspergillus flavus ATCC204304 Concentration: 0.5 μg/mL, 1 μg/mL Incubation Time: 18 hours Result: Inhibited the growth of Aspergillus flavus. References [1]. Napasawan Plabutong, et al. The Inhibitory Effect of Validamycin A on Aspergillus flavus. Int J Microbiol. 2020; 2020: 3972415. [2]. Zhi-Jiang Wang, et al. The effect of validamycin A on tyrosinase: inhibition kinetics and computational simulation. Int J Biol Macromol. 2013 Apr;55:15-23. Chemical & Physical Properties Density 1.7±0.1 g/cm3 Boiling Point 813.7±65.0 °C at 760 mmHg Melting Point 130-135ºC Molecular Formula C20H35NO13 Molecular Weight 497.491 Flash Point 445.9±34.3 °C Exact Mass 497.210846 PSA 253.02000 LogP -5.43 Vapour Pressure 0.0±6.6 mmHg at 25°C Index of Refraction 1.689 InChIKey JARYYMUOCXVXNK-CSLFJTBJSA-N SMILES OCC1=CC(NC2CC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Use ofProperties Name validamycin A Synonym More Synonyms Validamycin Biological Activity Related Catalog Research Areas >> Infection Signaling Pathways >> Anti-infection >> Fungal Signaling Pathways >> Metabolic Enzyme/Protease >> Tyrosinase References [1]. Napasawan Plabutong, et al. The Inhibitory Effect of Validamycin A on Aspergillus flavus. Int J Microbiol. 2020; 2020: 3972415. [2]. Zhi-Jiang Wang, et al. The effect of validamycin A on tyrosinase: inhibition kinetics and computational simulation. Int J Biol Macromol. 2013 Apr;55:15-23. Chemical & Physical Properties Molecular Formula C20H35NO13 Exact Mass 497.210846 PSA 253.02000 LogP -5.43 Index of Refraction 1.689 InChIKey JARYYMUOCXVXNK-CSLFJTBJSA-N
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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