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Fraxinellone

Fraxinellone structure

CAS No:
28808-62-0
Formula:
C14H16O3
Chemical Name:
Fraxinellone
Synonyms:
1(3H)-Isobenzofuranone,3-(3-furanyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-,(3R,3aR)-;Phthalide,3-(3-furyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-;1(3H)-Isobenzofuranone,3-(3-furanyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-,(3R-cis)-;(3R,3aR)-3-(3-Furanyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-1(3H)-isobenzofuranone;Fraxinellone
Categories:
Biochemical Engineering > Plant Extracts

Description

Fraxinellone is isolated from the root bark of the Rutaceae plant, Dictamnus dasycarpus. Fraxinellone is a PD-L1 inhibitor and inhibits HIF-1α protein synthesis without affecting HIF-1α protein degradation. Fraxinellone has the potential to be a valuable candidate for cancer treatment by targeting PD-L1[1].

Fraxinellone Basic Attributes

Molecular Weight：

232.277

Exact Mass：

232.27

NSC Number：

638730

HScode：

29321900

Characteristics

PSA：

39.4

XLogP3：

2.5

Density：

1.2±0.1 g/cm3

Melting Point：

117 °C

Boiling Point：

372.9°C at 760 mmHg

Flash Point：

179.3±24.6 °C

Refractive Index：

1.552

Vapor Pressure：

9.29E-06mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2811 6.1/PG III

safety instructions：

24/25

RTECS Number：

TI3767000

Precautionary statement(s)：

P301 + P310

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

fraxinellone

Computed Properties

Molecular Weight:232.27
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:232.109944368
Monoisotopic Mass:232.109944368
Topological Polar Surface Area:39.4
Heavy Atom Count:17
Complexity:385
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 28808-62-0

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Content: 99%

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Guide of Fraxinellone

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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