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Isotope-labelled compounds

Castasterone-d3

CAS 461670-13-3Formula C28H48O5Molar mass 467.71 g/mol
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Castasterone-d3 chemical structure, C28H48O5, CAS 461670-13-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
461670-13-3
Formula
C28H48O5
Molar mass
467.71 g/mol
HS code
284590
Category
Isotope-labelled compounds

What is Castasterone-d3?

Plain description, key identifiers and synonyms

Castasterone-d3 is a chemical substance with the molecular formula C28H48O5 and a molar mass of 467.71 g/mol. Its CAS registry number is 461670-13-3. The IUPAC name is (2R,3S,5S,8S,9S,10R,13S,14S,17R)-2,3-dihydroxy-10,13-dimethyl-17-[(2S,3R,4R,5S)-7,7,7-trideuterio-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R,3S,5S,8S,9S,10R,13S,14S,17R)-2,3-dihydroxy-10,13-dimethyl-17-[(2S,3R,4R,5S)-7,7,7-trideuterio-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
CAS number
461670-13-3
Molecular formula
C28H48O5
InChIKey
VYUIKSFYFRVQLF-RWKPNTNXSA-N
InChI
InChI=1S/C28H48O5/c1-14(2)15(3)25(32)26(33)16(4)18-7-8-19-17-11-22(29)21-12-23(30)24(31)13-28(21,6)20(17)9-10-27(18,19)5/h14-21,23-26,30-33H,7-13H2,1-6H3/t15-,16-,17-,18+,19-,20-,21+,23-,24+,25+,26+,27+,28+/m0/s1/i1D3/t14?,15-,16-,17-,18+,19-,20-,21+,23-,24+,25+,26+,27+,28+
Canonical SMILES
CC(C)C(C)C(O)C(O)C(C)C1CCC2C3CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C
Isomeric SMILES
[2H]C([2H])([2H])C(C)[C@H](C)[C@H]([C@@H]([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)O)O

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
467.71 g/molcalc.
Exact mass
467.369 Dacalc.
LogP (octanol/water)
3.81calc.
Topological polar surface area
97.99 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
5calc.
Heavy atoms
33calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.96calc.
Formal charge
0calc.
Stereocentres
14calc.
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=C1CC2C3CCCC3CCC2C2CCCCC12

O=C1CC2C3CCCC3CCC2C2CCCCC12

4 rings, 18 atoms.

69 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.

Castasterone-d3 suppliers

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Castasterone-d3 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 Castasterone-d3 is traded under.

HS 2845.90Indicative HS code

Compounds, inorganic or organic, of such isotopes, whether or not chemically defined

World exports in 2024
$2.67B
+19.0% vs 2023, imports $1.67B
2019 to 2024
Top exporters
  1. Ireland55.3%
  2. Hong Kong11.8%
  3. United States10.7%
Top importers
  1. China24.3%
  2. Ireland21.9%
  3. South Korea13.3%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Castasterone-d3 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Castasterone-d3, based on the data on this page

What is Castasterone-d3?

Castasterone-d3 is a chemical substance with the molecular formula C28H48O5 and a molar mass of 467.71 g/mol. Its CAS registry number is 461670-13-3.

What is the CAS number of Castasterone-d3?

The CAS registry number of Castasterone-d3 is 461670-13-3.

What is the molecular formula and weight of Castasterone-d3?

The molecular formula of Castasterone-d3 is C28H48O5 and its molar mass is 467.71 g/mol.

What is Castasterone-d3 used for?

Known uses and roles of Castasterone-d3 include isotope-labelled compounds in research and laboratory.

Is Castasterone-d3 hazardous?

No GHS hazard classification for Castasterone-d3 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 Castasterone-d3?

Castasterone-d3 is usually classified under HS code 284590 (Isotopes other than those of heading 2844, compounds, inorganic or organic, of such…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Castasterone-d3?

Post a free request on CompoundList and suppliers of Castasterone-d3 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Castasterone-d3?

Suppliers quote Castasterone-d3 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 Castasterone-d3

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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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