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Screening compounds

Sanshodiol

Also known as Tetrahydro-4-(1,3-benzodioxol-5-ylmethyl)-2-(4-hydroxy-3-methoxyphenyl)-3-furanmethanol, 4-[4-(1,3-benzodioxol-5-ylmethyl)-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol, 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(hydroxymethyl)oxolan-2-yl}-2-methoxyphenol

CAS 54854-91-0Formula C20H22O6Molar mass 358.39 g/mol
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Sanshodiol chemical structure, C20H22O6, CAS 54854-91-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
54854-91-0
Formula
C20H22O6
Molar mass
358.39 g/mol
HS code
293219
Category
Screening compounds

What is Sanshodiol?

Plain description, key identifiers and synonyms

Sanshodiol has been reported in Zanthoxylum piperitum and Zanthoxylum nitidum.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-[4-(1,3-benzodioxol-5-ylmethyl)-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
CAS number
54854-91-0
Molecular formula
C20H22O6
InChIKey
GRYMYKQGSSTJBA-UHFFFAOYSA-N
InChI
InChI=1S/C20H22O6/c1-23-18-8-13(3-4-16(18)22)20-15(9-21)14(10-24-20)6-12-2-5-17-19(7-12)26-11-25-17/h2-5,7-8,14-15,20-22H,6,9-11H2,1H3
SMILES (canonical and isomeric)
COC1=C(C=CC(=C1)C2C(C(CO2)CC3=CC4=C(C=C3)OCO4)CO)O

Synonyms

  • Tetrahydro-4-(1,3-benzodioxol-5-ylmethyl)-2-(4-hydroxy-3-methoxyphenyl)-3-furanmethanol
  • 4-[4-(1,3-benzodioxol-5-ylmethyl)-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
  • 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(hydroxymethyl)oxolan-2-yl}-2-methoxyphenol
  • 4,9-Dihydroxy-3-methoxy-3',4'-methylenedioxy-7,9'-epoxylignan
  • 3-Furanmethanol, 4-(1,3-benzodioxol-5-ylmethyl)tetrahydro-2-(4-hydroxy-3-methoxyphenyl)-

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
358.39 g/molcalc.
Exact mass
358.1416 Dacalc.
LogP (octanol/water)
2.67calc.
Topological polar surface area
77.38 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
5calc.
Heavy atoms
26calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.4calc.
Formal charge
0calc.
Stereocentres
3calc.
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(C2CC(Cc3ccc4c(c3)OCO4)CO2)cc1

c1ccc(C2CC(Cc3ccc4c(c3)OCO4)CO2)cc1

4 rings, 21 atoms.

No other chemical in our database has 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.

Sanshodiol suppliers

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

Frequently asked questions

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

What is Sanshodiol?

Sanshodiol has been reported in Zanthoxylum piperitum and Zanthoxylum nitidum.

What is the CAS number of Sanshodiol?

The CAS registry number of Sanshodiol is 54854-91-0.

What is the molecular formula and weight of Sanshodiol?

The molecular formula of Sanshodiol is C20H22O6 and its molar mass is 358.39 g/mol.

What is Sanshodiol used for?

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

Is Sanshodiol hazardous?

No GHS hazard classification for Sanshodiol 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 Sanshodiol?

Sanshodiol 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 Sanshodiol?

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

What is the price of Sanshodiol?

Suppliers quote Sanshodiol 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 Sanshodiol

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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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