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Screening compounds

Junceine

Also known as (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo(8.5.1.013,16)hexadec-10-ene-3,7-dione, (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

CAS 480-53-5Formula C18H27NO7Molar mass 369.41 g/mol
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Junceine chemical structure, C18H27NO7, CAS 480-53-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
480-53-5
Formula
C18H27NO7
Molar mass
369.41 g/mol
HS code
293499
Category
Screening compounds

What is Junceine?

Plain description, key identifiers and synonyms

Junceine is a chemical substance with the molecular formula C18H27NO7 and a molar mass of 369.41 g/mol. Its CAS registry number is 480-53-5. The IUPAC name is (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione
CAS number
480-53-5
Molecular formula
C18H27NO7
InChIKey
AAVMGRPGPSSZBQ-FOOXYVKASA-N
InChI
InChI=1S/C18H27NO7/c1-10(2)13-15(21)26-12-5-7-19-6-4-11(14(12)19)8-25-16(22)18(24,9-20)17(13,3)23/h4,10,12-14,20,23-24H,5-9H2,1-3H3/t12-,13+,14-,17-,18+/m1/s1
Canonical SMILES
CC(C)C1C(=O)OC2CCN3CC=C(COC(=O)C(O)(CO)C1(C)O)C23
Isomeric SMILES
CC(C)[C@H]1C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]([C@]1(C)O)(CO)O

Synonyms

  • (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo(8.5.1.013,16)hexadec-10-ene-3,7-dione
  • (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

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
369.41 g/molcalc.
Exact mass
369.1788 Dacalc.
LogP (octanol/water)
-0.78calc.
Topological polar surface area
116.5 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
2calc.
Heavy atoms
26calc.
Rings
3calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.78calc.
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, O=C1CCCC(=O)OC2CCN3CC=C(CO1)C23

O=C1CCCC(=O)OC2CCN3CC=C(CO1)C23

3 rings, 18 atoms.

32 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.

Junceine suppliers

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

Frequently asked questions

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

What is Junceine?

Junceine is a chemical substance with the molecular formula C18H27NO7 and a molar mass of 369.41 g/mol. Its CAS registry number is 480-53-5. The IUPAC name is (1R,4R,5R,6R,16R)-5,6-dihydroxy-6-(hydroxymethyl)-5-methyl-4-propan-2-yl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione.

What is the CAS number of Junceine?

The CAS registry number of Junceine is 480-53-5.

What is the molecular formula and weight of Junceine?

The molecular formula of Junceine is C18H27NO7 and its molar mass is 369.41 g/mol.

What is Junceine used for?

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

Is Junceine hazardous?

No GHS hazard classification for Junceine 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 Junceine?

Junceine 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 Junceine?

CompoundList lists 1 supplier of Junceine in United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Junceine?

Suppliers quote Junceine 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

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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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