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Heterocyclic compounds

Doronine

Also known as [(1R,4R,6R,7R,11Z)-4-[(1R)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate, 4,8-Secosenecionan-8,11,16-trione, 15,20-dihydro-12-(acetyloxy)-20-chloro-15-hydroxy-4-methyl-, ((1R,4R,6R,7R,11Z)-4-((1R)-1-chloroethyl)-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo(9.5.1)heptadec-11-en-7-yl) acetate

CAS 60367-00-2Formula C21H30ClNO8Molar mass 459.92 g/mol
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Doronine chemical structure, C21H30ClNO8, CAS 60367-00-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
60367-00-2
Formula
C21H30ClNO8
Molar mass
459.92 g/mol
HS code
293499
Category
Heterocyclic compounds

What is Doronine?

Plain description, key identifiers and synonyms

Doronine is a ketone and a carboxylic ester.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1R,4R,6R,7R,11Z)-4-[(1R)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
CAS number
60367-00-2
Molecular formula
C21H30ClNO8
InChIKey
VGRSISYREBBIAL-XAHVSKGQSA-N
InChI
InChI=1S/C21H30ClNO8/c1-12-10-21(28,13(2)22)19(27)30-16-7-9-23(5)8-6-15(17(16)25)11-29-18(26)20(12,4)31-14(3)24/h6,12-13,16,28H,7-11H2,1-5H3/b15-6-/t12-,13-,16-,20-,21+/m1/s1
Canonical SMILES
CC(=O)OC1(C)C(=O)OCC2=CCN(C)CCC(OC(=O)C(O)(C(C)Cl)CC1C)C2=O
Isomeric SMILES
C[C@@H]1C[C@@](C(=O)O[C@@H]2CCN(C/C=C(\C2=O)/COC(=O)[C@]1(C)OC(=O)C)C)([C@@H](C)Cl)O

Synonyms

  • [(1R,4R,6R,7R,11Z)-4-[(1R)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl] acetate
  • 4,8-Secosenecionan-8,11,16-trione, 15,20-dihydro-12-(acetyloxy)-20-chloro-15-hydroxy-4-methyl-
  • ((1R,4R,6R,7R,11Z)-4-((1R)-1-chloroethyl)-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo(9.5.1)heptadec-11-en-7-yl) acetate

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
459.92 g/molcalc.
Exact mass
459.166 Dacalc.
LogP (octanol/water)
0.99calc.
Topological polar surface area
119.4 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
2calc.
Heavy atoms
31calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.71calc.
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=C1CCCCC(=O)OC2CCNCC=C(CO1)C2=O

O=C1CCCCC(=O)OC2CCNCC=C(CO1)C2=O

2 rings, 20 atoms.

11 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.

Doronine suppliers

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Doronine 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

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

Frequently asked questions

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

What is Doronine?

Doronine is a ketone and a carboxylic ester.

What is the CAS number of Doronine?

The CAS registry number of Doronine is 60367-00-2.

What is the molecular formula and weight of Doronine?

The molecular formula of Doronine is C21H30ClNO8 and its molar mass is 459.92 g/mol.

Is Doronine hazardous?

No GHS hazard classification for Doronine 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 Doronine?

Doronine 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 Doronine?

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What is the price of Doronine?

Suppliers quote Doronine 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 Doronine

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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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