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Screening compounds

Amberline

Also known as Ambelline, (1R,13R,15R)-9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-ol, Crinan-11-ol, 1,2-didehydro-3,7-dimethoxy-, (3alpha,11S)-

Formula C18H21NO5Molar mass 331.37 g/mol
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Amberline chemical structure, C18H21NO5
2D chemical structure

Key facts

What buyers check first

All properties
Formula
C18H21NO5
Molar mass
331.37 g/mol
HS code
293499
Category
Screening compounds

What is Amberline?

Plain description, key identifiers and synonyms

Ambelline has been reported in Crinum stuhlmannii, Nerine undulata, and other organisms.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,13R,15R)-9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-ol
Molecular formula
C18H21NO5
InChIKey
QAHZAHIPKNLGAS-MUPGEQOCSA-N
InChI
InChI=1S/C18H21NO5/c1-21-10-3-4-18-12-6-13-17(24-9-23-13)16(22-2)11(12)7-19(8-15(18)20)14(18)5-10/h3-4,6,10,14-15,20H,5,7-9H2,1-2H3/t10-,14+,15?,18+/m0/s1
Canonical SMILES
COc1c2c(cc3c1OCO3)C13C=CC(OC)CC1N(C2)CC3O
Isomeric SMILES
CO[C@@H]1C[C@@H]2[C@]3(C=C1)C(CN2CC4=C(C5=C(C=C34)OCO5)OC)O

Synonyms

  • Ambelline
  • (1R,13R,15R)-9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-ol
  • Crinan-11-ol, 1,2-didehydro-3,7-dimethoxy-, (3alpha,11S)-
  • Crinan-18-ol, 1,2-didehydro-3,9-dimethoxy-, (3alpha,18S)-
  • 3,7-Dimethoxy-1,2-didehydrocrinan-11-ol
  • Crinan-12-ol,2-didehydro-3alpha,7-dimethoxy-
  • Crinan-12-ol, 1,2-didehydro-3alpha, 7-dimethoxy-
  • Crinan-11-ol,2-didehydro-3,7-dimethoxy-, (3alpha,11S)-
  • Crinan-18-ol,2-didehydro-3,9-dimethoxy-, (3alpha,18S)-

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
331.37 g/molcalc.
Exact mass
331.142 Dacalc.
LogP (octanol/water)
1.2calc.
Topological polar surface area
60.39 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
2calc.
Heavy atoms
24calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.56calc.
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, C1=CC23CCN(Cc4cc5c(cc42)OCO5)C3CC1

C1=CC23CCN(Cc4cc5c(cc42)OCO5)C3CC1

5 rings, 19 atoms.

21 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.

Amberline suppliers

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Amberline 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 Amberline is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Amberline?

Ambelline has been reported in Crinum stuhlmannii, Nerine undulata, and other organisms.

What is the molecular formula and weight of Amberline?

The molecular formula of Amberline is C18H21NO5 and its molar mass is 331.37 g/mol.

What is Amberline used for?

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

Is Amberline hazardous?

No GHS hazard classification for Amberline 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 Amberline?

Amberline is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Amberline?

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What is the price of Amberline?

Suppliers quote Amberline 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 Amberline

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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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