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Heterocyclic building blocks

Aurafuron A

Also known as 5-((2S,3Z,5E,7R,8R,9E)-2,8-dihydroxy-7,9,12-trimethyltrideca-3,5,9-trienyl)-2-hydroxy-2,4-dimethylfuran-3-one, 5-[(2S,3Z,5E,7R,8R,9E)-2,8-Dihydroxy-7,9,12-trimethyltrideca-3,5,9-trienyl]-2-hydroxy-2,4-dimethylfuran-3-one, (-)-aurafuron A

CAS 861954-56-5Formula C22H34O5Molar mass 378.51 g/mol
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Aurafuron A chemical structure, C22H34O5, CAS 861954-56-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
861954-56-5
Formula
C22H34O5
Molar mass
378.51 g/mol
HS code
293219
Category
Heterocyclic building blocks

What is Aurafuron A?

Plain description, key identifiers and synonyms

Aurafuron A is a polyketide that is 2,3-dihydrofuran substituted by hydroxy, methyl, oxo, methyl and (2S,3Z,5E,7R,8R,9E)-2,8-dihydroxy-7,9,12-trimethyltrideca-3,5,9-trien-1-yl groups at positions 2, 2, 3, 4, and 5, respectively. It is a cytotoxic natural product found in several myxobacteria species and inhibits the growth of some filamentous fungi. It has a role as a toxin, an antifungal agent and a bacterial metabolite. It is a secondary allylic alcohol, a tertiary alpha-hydroxy ketone, a polyketide, a member of oxolanes, a triol, a secondary alcohol and a lactol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-[(2S,3Z,5E,7R,8R,9E)-2,8-dihydroxy-7,9,12-trimethyltrideca-3,5,9-trienyl]-2-hydroxy-2,4-dimethylfuran-3-one
CAS number
861954-56-5
Molecular formula
C22H34O5
InChIKey
AQQYZHDRTDSOER-LYKBUVKOSA-N
InChI
InChI=1S/C22H34O5/c1-14(2)11-12-16(4)20(24)15(3)9-7-8-10-18(23)13-19-17(5)21(25)22(6,26)27-19/h7-10,12,14-15,18,20,23-24,26H,11,13H2,1-6H3/b9-7+,10-8-,16-12+/t15-,18-,20-,22?/m1/s1
Canonical SMILES
CC(=CCC(C)C)C(O)C(C)C=CC=CC(O)CC1=C(C)C(=O)C(C)(O)O1
Isomeric SMILES
CC1=C(OC(C1=O)(C)O)C[C@@H](/C=C\C=C\[C@@H](C)[C@H](/C(=C/CC(C)C)/C)O)O

Synonyms

  • 5-((2S,3Z,5E,7R,8R,9E)-2,8-dihydroxy-7,9,12-trimethyltrideca-3,5,9-trienyl)-2-hydroxy-2,4-dimethylfuran-3-one
  • 5-[(2S,3Z,5E,7R,8R,9E)-2,8-Dihydroxy-7,9,12-trimethyltrideca-3,5,9-trienyl]-2-hydroxy-2,4-dimethylfuran-3-one
  • (-)-aurafuron A

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
378.51 g/molcalc.
Exact mass
378.2406 Dacalc.
LogP (octanol/water)
3.42calc.
Topological polar surface area
86.99 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
9calc.
Heavy atoms
27calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.59calc.
Formal charge
0calc.
Stereocentres
4calc.
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=C1C=COC1

O=C1C=COC1

1 ring, 6 atoms, the 3(2H)-Furanone ring system.

110 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.

Aurafuron A suppliers

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Aurafuron A 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

  • antifungal agent
  • antimicrobial agent
  • bacterial metabolite
  • metabolite
  • poison
  • prokaryotic metabolite
  • toxin

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 Aurafuron A is traded under.

HS 2932.19Indicative HS code

Compounds containing an unfused furan ring (whether or not hydrogenated) in the…

World exports in 2024
$2.62B
−6.4% vs 2023, imports $2.56B
2019 to 2024
Top exporters
  1. Germany57.9%
  2. Italy11.5%
  3. China10.4%
Top importers
  1. Greece40.4%
  2. Japan16.3%
  3. Germany12.8%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Aurafuron A, based on the data on this page

What is Aurafuron A?

Aurafuron A is a polyketide that is 2,3-dihydrofuran substituted by hydroxy, methyl, oxo, methyl and (2S,3Z,5E,7R,8R,9E)-2,8-dihydroxy-7,9,12-trimethyltrideca-3,5,9-trien-1-yl groups at positions 2, 2, 3, 4, and 5, respectively.

What is the CAS number of Aurafuron A?

The CAS registry number of Aurafuron A is 861954-56-5.

What is the molecular formula and weight of Aurafuron A?

The molecular formula of Aurafuron A is C22H34O5 and its molar mass is 378.51 g/mol.

What is Aurafuron A used for?

Known uses and roles of Aurafuron A include building blocks in research and laboratory, antifungal agent, antimicrobial agent, bacterial metabolite, metabolite and 3 more.

Is Aurafuron A hazardous?

No GHS hazard classification for Aurafuron A 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 Aurafuron A?

Aurafuron A is usually classified under HS code 293219 (Compounds containing an unfused furan ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Aurafuron A?

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

What is the price of Aurafuron A?

Suppliers quote Aurafuron A 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 Aurafuron A

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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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