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SML3868

PG3d

≥97% (1H-NMR)

Synonym(s):

4-Hydroxy-2-(2-phenylethynyl)-5-(phenylmethyl)-6H-1,3-oxazin-6-one, 5-Benzyl-4-hydroxy-2-(phenylethynyl)-6H-1,3-oxazin-6-one

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About This Item

Empirical Formula (Hill Notation):
C19H13NO3
CAS Number:
1438463-77-4
Molecular Weight:
303.31
UNSPSC Code:
12352200
NACRES:
NA.21
MDL number:
MFCD32868440
Assay:
≥97% (1H-NMR)
Form:
powder
Storage condition:
desiccated
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Quality Segment

100

assay

≥97% (1H-NMR)

form

powder

storage condition

desiccated

color

white to beige

solubility

DMSO: 2 mg/mL, clear

storage temp.

2-8°C

SMILES string

N1=C(OC(=O)C(C1=O)Cc3ccccc3)C#Cc2ccccc2

InChI

1S/C19H13NO3/c21-18-16(13-15-9-5-2-6-10-15)19(22)23-17(20-18)12-11-14-7-3-1-4-8-14/h1-10,16H,13H2

InChI key

ZBZZHVGCNWRIGR-UHFFFAOYSA-N

Biochem/physiol Actions

Cell penetrant, potent and selective irreversible allosteric inhibitor of caspase-6 activation that binds outside the active site of caspase-6

Disclaimer

Hygroscopic

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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