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About This Item
Empirical Formula (Hill Notation):
C26H31Cl2N5O3
CAS Number:
Molecular Weight:
532.46
NACRES:
NA.77
UNSPSC Code:
12352200
Quality Level
assay
≥98% (HPLC)
form
powder
color
white to beige
solubility
DMSO: 2 mg/mL, clear
storage temp.
2-8°C
SMILES string
CC(C)N1CCN(C2=CC=C(OCC3OC(C4=CC=C(Cl)C=C4Cl)(CN5N=CN=C5)OC3)C=C2)CC1
InChI
1S/C26H31Cl2N5O3/c1-19(2)31-9-11-32(12-10-31)21-4-6-22(7-5-21)34-14-23-15-35-26(36-23,16-33-18-29-17-30-33)24-8-3-20(27)13-25(24)28/h3-8,13,17-19,23H,9-12,14-16H2,1-2H3/t23-,26-/m0/s1
InChI key
BLSQLHNBWJLIBQ-OZXSUGGESA-N
Biochem/physiol Actions
Potent inhibitor of fungal cytochrome P450 14-alpha-demethylase (lanosterol 14-alpha-demethylase)
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signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 4 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| SML3536-25MG | 04065268002186 |
| SML3536-5MG | 04065268002193 |
