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Screening compounds

Concentricol D

CAS 479669-81-3Formula C32H54O6Molar mass 534.78 g/mol
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Concentricol D chemical structure, C32H54O6, CAS 479669-81-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
479669-81-3
Formula
C32H54O6
Molar mass
534.78 g/mol
HS code
293299
Category
Screening compounds

What is Concentricol D?

Plain description, key identifiers and synonyms

Concentricol D is a triterpenoid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(E)-5-[(1S,2S,3S,4R)-2,4-dimethyl-3-[(3E,11E)-7,8,13-trihydroxy-4,8,12-trimethyltrideca-3,11-dienyl]-7-oxabicyclo[2.2.1]heptan-2-yl]-2-methylpent-2-enyl] acetate
CAS number
479669-81-3
Molecular formula
C32H54O6
InChIKey
MIYUGOVPVJJFCL-ZMJUVDRASA-N
InChI
InChI=1S/C32H54O6/c1-23(15-16-28(35)31(6,36)19-10-12-24(2)21-33)11-8-14-27-30(5,29-17-20-32(27,7)38-29)18-9-13-25(3)22-37-26(4)34/h11-13,27-29,33,35-36H,8-10,14-22H2,1-7H3/b23-11+,24-12+,25-13+/t27-,28?,29-,30-,31?,32+/m0/s1
Canonical SMILES
CC(=O)OCC(C)=CCCC1(C)C2CCC(C)(O2)C1CCC=C(C)CCC(O)C(C)(O)CCC=C(C)CO
Isomeric SMILES
C/C(=C\CC[C@@H]1[C@]2(CC[C@@H]([C@@]1(C)CC/C=C(\C)/COC(=O)C)O2)C)/CCC(C(C)(CC/C=C(\C)/CO)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
534.78 g/molcalc.
Exact mass
534.392 Dacalc.
LogP (octanol/water)
6.19calc.
Topological polar surface area
96.22 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
16calc.
Heavy atoms
38calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.78calc.
Formal charge
0calc.
Stereocentres
6calc.
Lipinski rule of five
Fails (2 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, C1CC2CCC1O2

C1CC2CCC1O2

2 rings, 7 atoms, the 7-Oxabicyclo(2.2.1)heptane ring system.

612 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.

Concentricol D suppliers

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Concentricol D 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 Concentricol D is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Concentricol D, based on the data on this page

What is Concentricol D?

Concentricol D is a triterpenoid.

What is the CAS number of Concentricol D?

The CAS registry number of Concentricol D is 479669-81-3.

What is the molecular formula and weight of Concentricol D?

The molecular formula of Concentricol D is C32H54O6 and its molar mass is 534.78 g/mol.

What is Concentricol D used for?

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

Is Concentricol D hazardous?

No GHS hazard classification for Concentricol D 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 Concentricol D?

Concentricol D is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Concentricol D?

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

What is the price of Concentricol D?

Suppliers quote Concentricol D 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 Concentricol D

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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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