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Heterocyclic compounds

(+)-Acuminatin

Also known as Acuminatin, (2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydro-1-benzofuran, Benzofuran, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-(1-propenyl)-, (2R-(2alpha,3beta,5(E)))-

CAS 41744-39-2Formula C21H24O4Molar mass 340.42 g/mol
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(+)-Acuminatin chemical structure, C21H24O4, CAS 41744-39-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
41744-39-2
Formula
C21H24O4
Molar mass
340.42 g/mol
HS code
293299
Category
Heterocyclic compounds

What is (+)-Acuminatin?

Plain description, key identifiers and synonyms

Acuminatin is a neolignan that is 5-[(1E)-prop-1-en-1-yl]-2,3-dihydro-1-benzofuran carrying additional 3,4-dimethoxyphenyl, methyl and methoxy substituents at positions 2, 3 and 7 respectively. It has a role as a plant metabolite and a fungal metabolite. It is a neolignan, a ring assembly, a member of 1-benzofurans, a dimethoxybenzene and an olefinic compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydro-1-benzofuran
CAS number
41744-39-2
Molecular formula
C21H24O4
UNII
JA2WFP75V2
InChIKey
ITFKWUHXYCXXFF-XSOBDOKWSA-N
InChI
InChI=1S/C21H24O4/c1-6-7-14-10-16-13(2)20(25-21(16)19(11-14)24-5)15-8-9-17(22-3)18(12-15)23-4/h6-13,20H,1-5H3/b7-6+/t13-,20-/m1/s1
Canonical SMILES
CC=Cc1cc(OC)c2c(c1)C(C)C(c1ccc(OC)c(OC)c1)O2
Isomeric SMILES
C/C=C/C1=CC2=C(C(=C1)OC)O[C@H]([C@@H]2C)C3=CC(=C(C=C3)OC)OC

Synonyms

  • Acuminatin
  • (2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydro-1-benzofuran
  • Benzofuran, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-(1-propenyl)-, (2R-(2alpha,3beta,5(E)))-
  • (2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-((E)-prop-1-enyl)-2,3-dihydro-1-benzofuran
  • (2R,3R)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-5-[(1E)-prop-1-en-1-yl]-2,3-dihydro-1-benzofuran
  • (2R,3R)-2-(3,4-Dimethoxyphenyl)-7-methoxy-3-methyl-5-((E)-prop-1-en-1-yl)-2,3-dihydrobenzofuran
  • Benzofuran, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-(1E)-1-propen-1-yl-, (2R,3R)-
  • (2R,3R)-2-(3,4-Dimethoxyphenyl)-2,3-dihydro-7-methoxy-3-methyl-5-(1E)-1-propen-1-ylbenzofuran

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
340.42 g/molcalc.
Exact mass
340.1675 Dacalc.
LogP (octanol/water)
4.98calc.
Topological polar surface area
36.92 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
5calc.
Heavy atoms
25calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
2calc.
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, c1ccc(C2Cc3ccccc3O2)cc1

c1ccc(C2Cc3ccccc3O2)cc1

3 rings, 15 atoms, the 2-Phenyl-2,3-dihydrobenzofuran ring system.

106 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.

(+)-Acuminatin suppliers

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(+)-Acuminatin 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

Roles

  • eukaryotic metabolite
  • fungal metabolite
  • metabolite
  • plant metabolite

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 (+)-Acuminatin is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about (+)-Acuminatin, based on the data on this page

What is (+)-Acuminatin?

Acuminatin is a neolignan that is 5-[(1E)-prop-1-en-1-yl]-2,3-dihydro-1-benzofuran carrying additional 3,4-dimethoxyphenyl, methyl and methoxy substituents at positions 2, 3 and 7 respectively. It has a role as a plant metabolite and a fungal metabolite.

What is the CAS number of (+)-Acuminatin?

The CAS registry number of (+)-Acuminatin is 41744-39-2.

What is the molecular formula and weight of (+)-Acuminatin?

The molecular formula of (+)-Acuminatin is C21H24O4 and its molar mass is 340.42 g/mol.

What is (+)-Acuminatin used for?

Known uses and roles of (+)-Acuminatin include eukaryotic metabolite, fungal metabolite, metabolite and plant metabolite.

Is (+)-Acuminatin hazardous?

No GHS hazard classification for (+)-Acuminatin 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 (+)-Acuminatin?

(+)-Acuminatin is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy (+)-Acuminatin?

CompoundList lists 1 supplier of (+)-Acuminatin in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of (+)-Acuminatin?

Suppliers quote (+)-Acuminatin 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

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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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