CompoundList
Sign in
Screening compounds

Agarotetrol

Also known as (5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one, Agarotetrol (AHl), Agarotetrol(AHl)

CAS 69809-22-9Formula C17H18O6Molar mass 318.33 g/mol
1 supplier listed
Get quotes See the supplier
Agarotetrol chemical structure, C17H18O6, CAS 69809-22-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
69809-22-9
Formula
C17H18O6
Molar mass
318.33 g/mol
HS code
293299
Category
Screening compounds

What is Agarotetrol?

Plain description, key identifiers and synonyms

Agarotetrol is a pyranone.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
CAS number
69809-22-9
Molecular formula
C17H18O6
MDL number
MFCD30533225
InChIKey
CWMIROLCTHMEEO-JJXSEGSLSA-N
InChI
InChI=1S/C17H18O6/c18-11-8-10(7-6-9-4-2-1-3-5-9)23-17-12(11)13(19)14(20)15(21)16(17)22/h1-5,8,13-16,19-22H,6-7H2/t13-,14+,15+,16-/m0/s1
Canonical SMILES
O=c1cc(CCc2ccccc2)oc2c1C(O)C(O)C(O)C2O
Isomeric SMILES
C1=CC=C(C=C1)CCC2=CC(=O)C3=C(O2)[C@H]([C@@H]([C@@H]([C@H]3O)O)O)O

Synonyms

  • (5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
  • Agarotetrol (AHl)
  • Agarotetrol(AHl)
  • (5S)-5,6,7,8-Tetrahydro-5alpha,6beta,7beta,8alpha-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
  • (5S,6R,7R,8S)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one
  • (5S,6R,7R,8S)-5,6,7,8-Tetrahydroxy-2-phenethyl-5,6,7,8-tetrahydro-4H-chromen-4-one
  • (5S)-5,6,7,8-Tetrahydro-5|A,6|A,7|A,8|A-tetrahydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
  • (5s,6r,7r,8s)-5,6,7,8-tetrahydroxy 2-(2-phenylethyl)-5,6,7,8-tetrahydro-4h-chromen-4-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
318.33 g/molcalc.
Exact mass
318.1103 Dacalc.
LogP (octanol/water)
0.23calc.
Topological polar surface area
111.1 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
3calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.35calc.
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=c1cc(CCc2ccccc2)oc2c1CCCC2

O=c1cc(CCc2ccccc2)oc2c1CCCC2

3 rings, 19 atoms.

12 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.

Agarotetrol suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

See the supplier

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

1 supplier in 1 country

Send one request to many suppliers

Choose up to 10 suppliers or let us match your request. Compare quotes side by side, free.

Choose suppliersPost a request

Agarotetrol price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

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 Agarotetrol 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 Agarotetrol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Agarotetrol?

Agarotetrol is a pyranone.

What is the CAS number of Agarotetrol?

The CAS registry number of Agarotetrol is 69809-22-9.

What is the molecular formula and weight of Agarotetrol?

The molecular formula of Agarotetrol is C17H18O6 and its molar mass is 318.33 g/mol.

What is Agarotetrol used for?

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

Is Agarotetrol hazardous?

No GHS hazard classification for Agarotetrol 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 Agarotetrol?

Agarotetrol 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 Agarotetrol?

CompoundList lists 1 supplier of Agarotetrol 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 Agarotetrol?

Suppliers quote Agarotetrol 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 Agarotetrol

Get quotes for Agarotetrol

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Agarotetrol
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Agarotetrol with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/agarotetrol-69809-22-9" title="Agarotetrol structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Screening compounds or HS code 293299

1 supplier
Free quotes, contact stays private
Get quotes