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Home > Products > Specialty & Industrial Chemicals > Specialty Chemicals > 15-ACETOXY-3ALPHA,7ALPHA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-EN-8-ONE
15-ACETOXY-3ALPHA,7ALPHA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-EN-8-ONE structure, CAS 88337-96-6

15-ACETOXY-3ALPHA,7ALPHA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-EN-8-ONE

CAS Number88337-96-6

Synonyms15-ADON; 15-ACETYLDEOXYNIVALENOL; Deoxynivalenol 15-Acetate; 15-acetoxy-3,7-dihydroxy-12,13-epoxytrichothec-9-en-8-one; 15-O-acetyl-4-deoxynivalenol; 15-ACETYLVOMITOXIN; 15-acetyl; 15-Acetyl-4-deoxynivalenol; 3-ACETYL-D3-DEOXYNIVALENOL; 15-ACDON; DON-15-acetate

Molecular FormulaC17H22O7

Molecular Weight338.35

Purity

Density1.42g/cm3

Boiling Point518.8ºC at 760 mmHg

Melting Point185°C-187°C

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symbol6.1(a)

Signal WordWarning

Cat. No.: 2A-1177712 Purity:
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Quality Control of [ 88337-96-6 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number88337-96-6
Catalog No.2A-1177712
Chinese Name15-O-乙酰脱氧瓜萎镰菌醇
Synonyms15-ADON; 15-ACETYLDEOXYNIVALENOL; Deoxynivalenol 15-Acetate; 15-acetoxy-3,7-dihydroxy-12,13-epoxytrichothec-9-en-8-one; 15-O-acetyl-4-deoxynivalenol; 15-ACETYLVOMITOXIN; 15-acetyl; 15-Acetyl-4-deoxynivalenol; 3-ACETYL-D3-DEOXYNIVALENOL; 15-ACDON; DON-15-acetate
Molecular FormulaC17H22O7
Molecular Weight338.35
Density1.42g/cm3
Boiling Point518.8ºC at 760 mmHg
Melting Point185°C-187°C
Appearancepowder
Storage Condition2-8°C
PackagingI
Application15-Acetyl-deoxynivalenol is a highly toxic trichothecene found in cereals and is toxic to HepG2 cells.
HTC29329990
PubChem ID24890561
MDL NumberMFCD00083218
SMILESCC(=O)OC[C@]12[C@H](O)C(=O)C(C)=C[C@H]1O[C@@H]3[C@H](O)C[C@@]2(C)[C@]34CO4
InChI1S/C17H22O7/c1-8-4-11-16(6-22-9(2)18,13(21)12(8)20)15(3)5-10(19)14(24-11)17(15)7-23-17/h4,10-11,13-14,19,21H,5-7H2,1-3H3/t10-,11-,13-,14-,15-,16-,17+/m1/s1
InChI KeyIDGRYIRJIFKTAN-HTJQZXIKSA-N
NACRES CodeNA.77
UNSPSC12352116
Hazard Symbols6.1(a)
Bioactivity15-Acetyl-deoxynivalenol is a highly toxic trichothecene found in cereals, and a metabolite of deoxynivalenol, exhibits toxicity to HepG2 cells[1]. Related Catalog Research Areas >> Cancer References [1]. Juan-García A, et al. Binary and tertiary combination of alternariol, 3-acetyl-deoxynivalenol and 15-acetyl-deoxynivalenol on HepG2 cells: Toxic effects and evaluation of degradation products. Toxicol In Vitro. 2016 Aug;34:264-273. Chemical & Physical Properties Density 1.42g/cm3 Boiling Point 518.8ºC at 760 mmHg Melting Point 185°C-187°C Molecular Formula C17H22O7 Molecular Weight 338.35200 Flash Point 2ºC Exact Mass 338.13700 PSA 105.59000 Index of Refraction 1.595 InChIKey IDGRYIRJIFKTAN-HTJQZXIKSA-N SMILES CC(=O)OCC12C(C=C(C)C(=O)C1O)OC1C(O)CC2(C)C12CO2 Storage condition 2-8°C
Use ofProperties Articles45 Name 15-acetoxy-3alpha,7alpha-dihydroxy-12,13-epoxytrichothec-9-en-8-one Synonym More Synonyms 15-Acetyl-deoxynivalenol Biological Activity Related Catalog Research Areas >> Cancer References Chemical & Physical Properties Molecular Formula C17H22O7 Exact Mass 338.13700 PSA 105.59000 Index of Refraction 1.595 InChIKey IDGRYIRJIFKTAN-HTJQZXIKSA-N
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2811 International Dangerous Regulations for sea transport: 2811 International Dangerous Regulations for air transport: 2811 14.2 United Nations shipping name European land transport hazard regulations: TOXIC SOLID, ORGANIC, N.O.S. ((3α,7α)- 15-(Acetyloxy)-12,13-epoxy-3,7-dihydroxy- trichothec-9-en-8-one) IMDG: TOXIC SOLID, ORGANIC, N.O.S. ((3α,7α)- 15-(Acetyloxy)-12,13-epoxy-3,7-dihydroxy- trichothec-9-en-8-one) International air transport hazard regulations: Toxic solid, organic, n.o.s. ((3α,7α)- 15-(Acetyloxy)-12,13-epoxy-3,7-dihydroxy-trichothec-9- en-8-one) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 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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