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Screening compounds

Agn192093

Also known as AGN 192093, (1S,5S,6R,7R)-6-[(2Z)-7-hydroxyhept-2-en-1-yl]-7-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,4-dioxabicyclo[3.2.1]octan-3-one, (1S,5S,6R,7R)-6-((2Z)-7-hydroxyhept-2-en-1-yl)-7-((1E,3S)-3-hydroxyoct-1-en-1-yl)-2,4-dioxabicyclo(3.2.1)octan-3-one

CAS 159359-95-2Formula C21H34O5Molar mass 366.50 g/mol
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Agn192093 chemical structure, C21H34O5, CAS 159359-95-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
159359-95-2
Formula
C21H34O5
Molar mass
366.50 g/mol
HS code
292090
Category
Screening compounds

What is Agn192093?

Plain description, key identifiers and synonyms

Agn192093 is a chemical substance with the molecular formula C21H34O5 and a molar mass of 366.50 g/mol. Its CAS registry number is 159359-95-2. The IUPAC name is (1S,5S,6R,7R)-6-[(Z)-7-hydroxyhept-2-enyl]-7-[(E,3S)-3-hydroxyoct-1-enyl]-2,4-dioxabicyclo[3.2.1]octan-3-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,5S,6R,7R)-6-[(Z)-7-hydroxyhept-2-enyl]-7-[(E,3S)-3-hydroxyoct-1-enyl]-2,4-dioxabicyclo[3.2.1]octan-3-one
CAS number
159359-95-2
Molecular formula
C21H34O5
InChIKey
PTIUXNGGNGQHQK-KTEVXADTSA-N
InChI
InChI=1S/C21H34O5/c1-2-3-7-10-16(23)12-13-18-17(11-8-5-4-6-9-14-22)19-15-20(18)26-21(24)25-19/h5,8,12-13,16-20,22-23H,2-4,6-7,9-11,14-15H2,1H3/b8-5-,13-12+/t16-,17+,18+,19-,20-/m0/s1
Canonical SMILES
CCCCCC(O)C=CC1C2CC(OC(=O)O2)C1CC=CCCCCO
Isomeric SMILES
CCCCC[C@@H](/C=C/[C@H]1[C@@H]2C[C@@H]([C@@H]1C/C=C\CCCCO)OC(=O)O2)O

Synonyms

  • AGN 192093
  • (1S,5S,6R,7R)-6-[(2Z)-7-hydroxyhept-2-en-1-yl]-7-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-2,4-dioxabicyclo[3.2.1]octan-3-one
  • (1S,5S,6R,7R)-6-((2Z)-7-hydroxyhept-2-en-1-yl)-7-((1E,3S)-3-hydroxyoct-1-en-1-yl)-2,4-dioxabicyclo(3.2.1)octan-3-one
  • (1S,5S,6R,7R)-6-[(Z)-7-Hydroxyhept-2-enyl]-7-[(E,3S)-3-hydroxyoct-1-enyl]-2,4-dioxabicyclo[3.2.1]octan-3-one

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
366.50 g/molcalc.
Exact mass
366.2406 Dacalc.
LogP (octanol/water)
4.13calc.
Topological polar surface area
75.99 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
12calc.
Heavy atoms
26calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.76calc.
Formal charge
0calc.
Stereocentres
5calc.
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=C1OC2CCC(C2)O1

O=C1OC2CCC(C2)O1

2 rings, 9 atoms.

1 other chemical 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.

Agn192093 suppliers

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Agn192093 price

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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 Agn192093 is traded under.

HS 2920.90Indicative HS code

Esters, other than thiophosphoric esters (phosphorothioates) and phosphite esters and their salts…

World exports in 2024
$1.05B
+8.0% vs 2023, imports $1.23B
2019 to 2024
Top exporters
  1. China33.4%
  2. Germany18.8%
  3. United States12.4%
Top importers
  1. United States19.2%
  2. Singapore8.9%
  3. South Korea6.9%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Agn192093 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Agn192093, based on the data on this page

What is Agn192093?

Agn192093 is a chemical substance with the molecular formula C21H34O5 and a molar mass of 366.50 g/mol. Its CAS registry number is 159359-95-2. The IUPAC name is (1S,5S,6R,7R)-6-[(Z)-7-hydroxyhept-2-enyl]-7-[(E,3S)-3-hydroxyoct-1-enyl]-2,4-dioxabicyclo[3.2.1]octan-3-one.

What is the CAS number of Agn192093?

The CAS registry number of Agn192093 is 159359-95-2.

What is the molecular formula and weight of Agn192093?

The molecular formula of Agn192093 is C21H34O5 and its molar mass is 366.50 g/mol.

What is Agn192093 used for?

Known uses and roles of Agn192093 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Agn192093 hazardous?

No GHS hazard classification for Agn192093 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 Agn192093?

Agn192093 is usually classified under HS code 292090 (Esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Agn192093?

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What is the price of Agn192093?

Suppliers quote Agn192093 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

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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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