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Acid, base and phase-transfer catalysts

(-)-N-Methylcaryachine

Also known as (1S,12S)-15-methoxy-20,20-dimethyl-5,7-dioxa-20-azoniapentacyclo(10.7.1.02,10.04,8.013,18)icosa-2,4(8),9,13,15,17-hexaen-16-ol, (1S,12S)-15-methoxy-20,20-dimethyl-5,7-dioxa-20-azoniapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol

CAS 70518-44-4Formula C20H22NO4+Molar mass 340.40 g/mol
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(-)-N-Methylcaryachine chemical structure, C20H22NO4+, CAS 70518-44-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
70518-44-4
Formula
C20H22NO4+
Molar mass
340.40 g/mol
HS code
293499
Category
Acid, base and phase-transfer catalysts

What is (-)-N-Methylcaryachine?

Plain description, key identifiers and synonyms

(-)-N-methylcaryachine has been reported in Cryptocarya chinensis.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,12S)-15-methoxy-20,20-dimethyl-5,7-dioxa-20-azoniapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol
CAS number
70518-44-4
Molecular formula
C20H22NO4+
InChIKey
QZLIBOXIXWAWSR-HOTGVXAUSA-O
InChI
InChI=1S/C20H21NO4/c1-21(2)15-4-11-6-17(22)18(23-3)8-13(11)16(21)5-12-7-19-20(9-14(12)15)25-10-24-19/h6-9,15-16H,4-5,10H2,1-3H3/p+1/t15-,16-/m0/s1
Canonical SMILES
COc1cc2c(cc1O)CC1c3cc4c(cc3CC2[N+]1(C)C)OCO4
Isomeric SMILES
C[N+]1([C@H]2CC3=CC(=C(C=C3[C@@H]1CC4=CC5=C(C=C24)OCO5)OC)O)C

Synonyms

  • (1S,12S)-15-methoxy-20,20-dimethyl-5,7-dioxa-20-azoniapentacyclo(10.7.1.02,10.04,8.013,18)icosa-2,4(8),9,13,15,17-hexaen-16-ol
  • (1S,12S)-15-methoxy-20,20-dimethyl-5,7-dioxa-20-azoniapentacyclo[10.7.1.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-16-ol

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
340.40 g/molcalc.
Exact mass
340.1543 Dacalc.
LogP (octanol/water)
3.1calc.
Topological polar surface area
47.92 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
1calc.
Heavy atoms
25calc.
Rings
5calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.4calc.
Formal charge
1calc.
Stereocentres
2calc.
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)CC1NC2Cc2cc3c(cc21)OCO3

c1ccc2c(c1)CC1NC2Cc2cc3c(cc21)OCO3

5 rings, 20 atoms.

2 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.

(-)-N-Methylcaryachine suppliers

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(-)-N-Methylcaryachine price

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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

Frequently asked questions

Quick answers about (-)-N-Methylcaryachine, based on the data on this page

What is (-)-N-Methylcaryachine?

(-)-N-methylcaryachine has been reported in Cryptocarya chinensis.

What is the CAS number of (-)-N-Methylcaryachine?

The CAS registry number of (-)-N-Methylcaryachine is 70518-44-4.

What is the molecular formula and weight of (-)-N-Methylcaryachine?

The molecular formula of (-)-N-Methylcaryachine is C20H22NO4+ and its molar mass is 340.40 g/mol.

Is (-)-N-Methylcaryachine hazardous?

No GHS hazard classification for (-)-N-Methylcaryachine 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 (-)-N-Methylcaryachine?

(-)-N-Methylcaryachine 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 (-)-N-Methylcaryachine?

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What is the price of (-)-N-Methylcaryachine?

Suppliers quote (-)-N-Methylcaryachine 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 (-)-N-Methylcaryachine

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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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