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Screening compounds

Fagaronine

Also known as 3,8,9-trimethoxy-5-methylbenzo[c]phenanthridin-5-ium-2-ol, Benzo(c)phenanthridinium, 2-hydroxy-3,8,9-trimethoxy-5-methyl-, 2-hydroxy-3,8,9-trimethoxy-5-methylbenzo[c]phenanthridinium

CAS 52259-65-1Formula C21H20NO4+Molar mass 350.39 g/mol
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Fagaronine chemical structure, C21H20NO4+, CAS 52259-65-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
52259-65-1
Formula
C21H20NO4+
Molar mass
350.39 g/mol
HS code
293399
Category
Screening compounds

What is Fagaronine?

Plain description, key identifiers and synonyms

Fagaronine is a benzophenanthridine alkaloid. It has a role as a mutagen.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3,8,9-trimethoxy-5-methylbenzo[c]phenanthridin-5-ium-2-ol
CAS number
52259-65-1 CAS number cross-checked
Molecular formula
C21H20NO4+
UNII
59HNE8RJS6
InChIKey
OOKZVPUCASIEBL-UHFFFAOYSA-O
InChI
InChI=1S/C21H19NO4/c1-22-11-13-8-19(25-3)20(26-4)9-15(13)14-6-5-12-7-17(23)18(24-2)10-16(12)21(14)22/h5-11H,1-4H3/p+1
SMILES (canonical and isomeric)
C[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C=C3)O)OC)OC)OC

Synonyms

  • 3,8,9-trimethoxy-5-methylbenzo[c]phenanthridin-5-ium-2-ol
  • Benzo(c)phenanthridinium, 2-hydroxy-3,8,9-trimethoxy-5-methyl-
  • 2-hydroxy-3,8,9-trimethoxy-5-methylbenzo[c]phenanthridinium
  • 2-Hydroxy-3,8,9-trimethoxy-5-methylbenzo(c)phenanthridinium
  • 3,8,9-trimethoxy-5-methylbenzo(c)phenanthridin-5-ium-2-ol
  • 3,8,9-trimethoxy-5-methyl-5H-benzo(c)phenanthridin-5-ium-2-one
  • 3,8,9-trimethoxy-5-methylbenzo(c)phenanthridin-5-ium-2-ol, chloride
  • 2-Hydroxy-3,8,9-trimethoxy-5-methylbenzo[c]phenanthridin-5-ium
  • BENZO(c)PHENANTHRIDINIUM, 2-HYDROXY-5-METHYL-3,8,9-TRIMETHOXY-
  • 3,8,9-trimethoxy-5-methyl-benzo[c]phenanthridin-5-ium-2-ol
  • 3,8,9-Trimethoxy-5-methyl-5lambda~5~-benzo[c]phenanthridin-2-ol
  • {Benzo[c]phenanthridinium,} 2-hydroxy-3,8,9-trimethoxy-5-methyl-, chloride (MF1)

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
350.39 g/molcalc.
Exact mass
350.1387 Dacalc.
LogP (octanol/water)
3.7calc.
Topological polar surface area
51.8 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
26calc.
Rings
4calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.19calc.
Formal charge
1calc.
Stereocentres
0calc.
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, c1ccc2c(c1)cnc1c3ccccc3ccc21

c1ccc2c(c1)cnc1c3ccccc3ccc21

4 rings, 18 atoms, the Benzo(c)phenanthridine ring system.

26 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.

Fagaronine suppliers

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

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Fagaronine 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

Pharmacological actions

  • Antineoplastic Agents
  • Antineoplastic Agents, Phytogenic

Roles

  • aetiopathogenetic role
  • genotoxin
  • mutagen

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 Fagaronine is traded under.

HS 2933.99Indicative HS code

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

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Fagaronine?

Fagaronine is a benzophenanthridine alkaloid. It has a role as a mutagen.

What is the CAS number of Fagaronine?

The CAS registry number of Fagaronine is 52259-65-1.

What is the molecular formula and weight of Fagaronine?

The molecular formula of Fagaronine is C21H20NO4+ and its molar mass is 350.39 g/mol.

What is Fagaronine used for?

Known uses and roles of Fagaronine include building blocks in research and laboratory, screening compounds in research and laboratory, aetiopathogenetic role, genotoxin, mutagen and 2 more.

Is Fagaronine hazardous?

No GHS hazard classification for Fagaronine 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 Fagaronine?

Fagaronine is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Fagaronine?

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

What is the price of Fagaronine?

Suppliers quote Fagaronine 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 Fagaronine

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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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