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Screening compounds

Anomaluone

Also known as Kaur-1-en-3-one, 16,17-dihydroxy-, (16alpha)-, (5beta,8alpha,10alpha,13alpha)-16,17-Dihydroxykaur-1-en-3-one

CAS 130774-30-0Formula C20H30O3Molar mass 318.46 g/mol
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Anomaluone chemical structure, C20H30O3, CAS 130774-30-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
130774-30-0
Formula
C20H30O3
Molar mass
318.46 g/mol
HS code
291440
Category
Screening compounds

What is Anomaluone?

Plain description, key identifiers and synonyms

Anomaluone is a chemical substance with the molecular formula C20H30O3 and a molar mass of 318.46 g/mol. Its CAS registry number is 130774-30-0. The IUPAC name is (1S,4S,9S,10S,13R,14S)-14-hydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadec-7-en-6-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,4S,9S,10S,13R,14S)-14-hydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadec-7-en-6-one
CAS number
130774-30-0
Molecular formula
C20H30O3
InChIKey
JZXWITIZXDCGSC-FFCBISMGSA-N
InChI
InChI=1S/C20H30O3/c1-17(2)14-6-9-19-10-13(20(23,11-19)12-21)4-5-15(19)18(14,3)8-7-16(17)22/h7-8,13-15,21,23H,4-6,9-12H2,1-3H3/t13-,14-,15-,18-,19+,20-/m1/s1
Canonical SMILES
CC1(C)C(=O)C=CC2(C)C3CCC4CC3(CCC12)CC4(O)CO
Isomeric SMILES
C[C@@]12C=CC(=O)C([C@H]1CC[C@]34[C@@H]2CC[C@H](C3)[C@@](C4)(CO)O)(C)C

Synonyms

  • Kaur-1-en-3-one, 16,17-dihydroxy-, (16alpha)-
  • (5beta,8alpha,10alpha,13alpha)-16,17-Dihydroxykaur-1-en-3-one

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
318.46 g/molcalc.
Exact mass
318.2195 Dacalc.
LogP (octanol/water)
3.1calc.
Topological polar surface area
57.53 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
1calc.
Heavy atoms
23calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.85calc.
Formal charge
0calc.
Stereocentres
6calc.
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=C1C=CC2C(CCC34CCC(CCC23)C4)C1

O=C1C=CC2C(CCC34CCC(CCC23)C4)C1

4 rings, 17 atoms.

No other chemical in our database has 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.

Anomaluone suppliers

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Anomaluone 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 Anomaluone is traded under.

HS 2914.40Indicative HS code

Ketone-alcohols and ketone-aldehydes

World exports in 2024
$199M
+2.5% vs 2023, imports $247M
2019 to 2024
Top exporters
  1. China29.5%
  2. Germany14.4%
  3. Netherlands12.7%
Top importers
  1. United States37.2%
  2. Netherlands8.5%
  3. Germany6.4%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Anomaluone?

Anomaluone is a chemical substance with the molecular formula C20H30O3 and a molar mass of 318.46 g/mol. Its CAS registry number is 130774-30-0. The IUPAC name is (1S,4S,9S,10S,13R,14S)-14-hydroxy-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadec-7-en-6-one.

What is the CAS number of Anomaluone?

The CAS registry number of Anomaluone is 130774-30-0.

What is the molecular formula and weight of Anomaluone?

The molecular formula of Anomaluone is C20H30O3 and its molar mass is 318.46 g/mol.

What is Anomaluone used for?

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

Is Anomaluone hazardous?

No GHS hazard classification for Anomaluone 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 Anomaluone?

Anomaluone is usually classified under HS code 291440 (Ketone-alcohols and ketone-aldehydes). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Anomaluone?

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

What is the price of Anomaluone?

Suppliers quote Anomaluone 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 Anomaluone

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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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