36519-25-2

Basic information

• Product Name: NEOSOLANIOL
• Synonyms: 12,13-epoxy-4-beta,15-diacetoxy-3-alpha,8-alpha-dihydroxy-trichothec-9-en;8-HYDROXYDIACETOXYSCIRPENOL;4BETA,15-DIACETOXY-3ALPHA,8ALPHA-DIHYDROXY-12,13-EPOXYTRICHOTHEC-9-ENE;NEOSOLANIOL;NEOSOLANIOL FROM FUSARIUM SPECIES;4β,15-diacetoxy-3α,8α-dihydroxy-12,13-epoxytrichothec-9-ene;neosolaniol from fusarium sp.;neosolaniol solution
• CAS NO: 36519-25-2
• Molecular Formula: C₁₉H₂₆O₈
• Molecular Weight: 366.41
• Mol File: 36519-25-2.mol
• Article Data: 4

Chemical Properties

• Melting Point: 171.5°C
• Boiling Point: 420.3°C (rough estimate)
• Flash Point: 2 °C
• Appearance: /
• Density: 1.2248 (rough estimate)
• Vapor Pressure: 8.46E-13mmHg at 25°C
• Refractive Index: 1.4430 (estimate)
• Storage Temp.: 2-8°C
• PKA: 13.32±0.70(Predicted)
• CAS DataBase Reference: NEOSOLANIOL(CAS DataBase Reference)
• NIST Chemistry Reference: NEOSOLANIOL(36519-25-2)
• EPA Substance Registry System: NEOSOLANIOL(36519-25-2)

Safety Data

• Hazard Codes: T+,Xn,F
• Statements: 26/27/28-36-20/21/22-11
• Safety Statements: 22-36/37/39-45-36/37-16-26
• RIDADR: UN 2811 6.1/PG 1
• WGK Germany: 3
• RTECS: YD0080000
• HazardClass: 6.1(a)
• PackingGroup: I
• Hazardous Substances Data: 36519-25-2(Hazardous Substances Data)

Usage

Chemical Properties

Solid

Uses

Neosolaniol is a mycotoxin produced by Fusarium species commonly found in wheat and maize.

InChI:InChI=1/C19H26O8/c1-9-5-13-18(6-12(9)22,7-24-10(2)20)17(4)15(26-11(3)21)14(23)16(27-13)19(17)8-25-19/h5,12-16,22-23H,6-8H2,1-4H3/t12-,13?,14+,15+,16+,17+,18+,19+/m0/s1

Upstream product

• 2270-40-8 anguidine 
• 108947-28-0 4β,15-diacetoxy-3α-(2-tetrahydropyranyloxy)scirpene-8β-ol 
• 81331-38-6 4β,15-diacetoxy-8-bromoscirpen-3α-ol 
• 77620-47-4 4β,15-diacetoxy-3α-hydroxyscirpen-8-one 
• 36519-25-2 4β,15-diacetoxyscirpene-3α,8β-diol 
• 21259-20-1 T-2 toxin 
• 77620-47-4 4β,15-Diacetoxy-3α-hydroxy-12,13-epoxytrichothec-9-en-8-one 

Downstream Products

• 65725-06-6 Diacetylneosolaniol 
• 65041-92-1 8-acetyl-neosolaniol 
• 68165-53-7 3α,4β,15-Triacetoxy-8α-hydroxy-12,13-epoxytrichothec-9-ene 
• 77620-55-4 4β,15-diacetoxyscirpene-3,8-dione 
• 77620-47-4 4β,15-diacetoxy-3α-hydroxyscirpen-8-one 
• 106325-54-6 C₃₃H₃₂Br₂O₁₀ 
• 77620-58-7 15-acetoxy-4β-(methacryloyloxy)scirpene-3,8-dione 
• 81331-42-2 15-acetoxy-4β-(methacryloyloxy)scirpene-3α,8β-diol 
• 77620-59-8 4β,15-bis(methacryloyloxy)scirpene-3,8-dione 
• 81331-43-3 4β,15-bis(methacryloyloxy)scirpene-3α,8β-diol 
• 36519-25-2 4β,15-diacetoxyscirpene-3α,8α-diol 
• 76348-84-0 15-deacetylneosolaniol 
• 76348-84-0 4β-Acetoxy-3α,8α,15-trihydroxy-12,13-epoxytrichothec-9-ene 
• 77620-47-4 4β,15-Diacetoxy-3α-hydroxy-12,13-epoxytrichothec-9-en-8-one 

Relevant articles and documents

Structure-function analysis of porcine cytochrome P450 3A29 in the hydroxylation of T-2 toxin as revealed by docking and mutagenesis studies

T-2 toxin, one of the type A trichothecenes, presents a potential hazard to human and animal health. Our previous work demonstrated that porcine cytochrome P450 3A29 (CYP3A29) played an important role in the hydroxylation of T-2 toxin. To identify amino a

THE FACILE CONVERSION OF T-2 TOXIN AND NEOSOLANIOL INTO ANGUIDINE

T-2 Toxin (5) and neosolaniol (6) are readily converted into anguidine (1) by a procedure where deoxygenation at the C-8 position is achieved, after conversion of the 3-TBDMS ether 7 of neosolaniol (6) to the β-bromide 11 for reduction to the anguidine precursor 12.