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Screening compounds

Asperfumin

Also known as 5-hydroxy-2-(6-hydroxy-2-methoxy-4-methylbenozyl)-3,6-dimethoxybenzoic acid methyl ester, 5-hydroxyl-2-(6-hydroxyl-2-methoxyl-4-methylbenzoyl)-3,6-dimethoxyl-benzoic methyl ester

CAS 848073-03-0Formula C19H20O8Molar mass 376.36 g/mol
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Asperfumin chemical structure, C19H20O8, CAS 848073-03-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
848073-03-0
Formula
C19H20O8
Molar mass
376.36 g/mol
HS code
291899
Category
Screening compounds

What is Asperfumin?

Plain description, key identifiers and synonyms

5-Hydroxyl-2-(6-hydroxyl-2-methoxyl-4-methylbenzoyl)-3,6-dimethoxyl-benzoic methyl ester has been reported in Aspergillus fumigatus and Rumex.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl 5-hydroxy-2-(2-hydroxy-6-methoxy-4-methylbenzoyl)-3,6-dimethoxybenzoate
CAS number
848073-03-0
Molecular formula
C19H20O8
InChIKey
BAPCVTZQKDDQAD-UHFFFAOYSA-N
InChI
InChI=1S/C19H20O8/c1-9-6-10(20)14(12(7-9)24-2)17(22)15-13(25-3)8-11(21)18(26-4)16(15)19(23)27-5/h6-8,20-21H,1-5H3
SMILES (canonical and isomeric)
CC1=CC(=C(C(=C1)OC)C(=O)C2=C(C=C(C(=C2C(=O)OC)OC)O)OC)O

Synonyms

  • 5-hydroxy-2-(6-hydroxy-2-methoxy-4-methylbenozyl)-3,6-dimethoxybenzoic acid methyl ester
  • 5-hydroxyl-2-(6-hydroxyl-2-methoxyl-4-methylbenzoyl)-3,6-dimethoxyl-benzoic methyl ester

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
376.36 g/molcalc.
Exact mass
376.1158 Dacalc.
LogP (octanol/water)
2.45calc.
Topological polar surface area
111.5 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
6calc.
Heavy atoms
27calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.26calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(c1ccccc1)c1ccccc1

O=C(c1ccccc1)c1ccccc1

2 rings, 14 atoms, the Benzophenone ring system.

5,108 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Asperfumin suppliers

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Asperfumin price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Asperfumin is traded under.

HS 2918.99Indicative HS code

Carboxylic acids, with additional oxygen function (not alcohol, phenol, aldehyde or ketone)…

World exports in 2024
$1.46B
−1.1% vs 2023, imports $1.54B
2019 to 2024
Top exporters
  1. China40.0%
  2. India * partner reported26.6%
  3. Germany8.0%
Top importers
  1. United States25.6%
  2. Brazil6.7%
  3. Argentina5.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Asperfumin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Asperfumin, based on the data on this page

What is Asperfumin?

5-Hydroxyl-2-(6-hydroxyl-2-methoxyl-4-methylbenzoyl)-3,6-dimethoxyl-benzoic methyl ester has been reported in Aspergillus fumigatus and Rumex.

What is the CAS number of Asperfumin?

The CAS registry number of Asperfumin is 848073-03-0.

What is the molecular formula and weight of Asperfumin?

The molecular formula of Asperfumin is C19H20O8 and its molar mass is 376.36 g/mol.

What is Asperfumin used for?

Known uses and roles of Asperfumin include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Asperfumin hazardous?

No GHS hazard classification for Asperfumin is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Asperfumin?

Asperfumin is usually classified under HS code 291899 (Carboxylic acids with additional oxygen function and their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Asperfumin?

Post a free request on CompoundList and suppliers of Asperfumin will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Asperfumin?

Suppliers quote Asperfumin on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Asperfumin

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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