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Screening compounds

Microlobin

Also known as ((1R,3R,4S,4aS,8R,8aS)-3,4,8,8a-tetramethyl-7-oxo-4-((2-oxochromen-7-yl)oxymethyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl) acetate

CAS 89803-98-5Formula C26H32O6Molar mass 440.54 g/mol
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Microlobin chemical structure, C26H32O6, CAS 89803-98-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
89803-98-5
Formula
C26H32O6
Molar mass
440.54 g/mol
HS code
293220
Category
Screening compounds

What is Microlobin?

Plain description, key identifiers and synonyms

Microlobin has been reported in Ferula assa-foetida, Ferula szowitziana, and Ferula microloba.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1R,3R,4S,4aS,8R,8aS)-3,4,8,8a-tetramethyl-7-oxo-4-[(2-oxochromen-7-yl)oxymethyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl] acetate
CAS number
89803-98-5
Molecular formula
C26H32O6
InChIKey
PIGAODQEDMJGTF-BXTCTJPFSA-N
InChI
InChI=1S/C26H32O6/c1-15-12-23(31-17(3)27)26(5)16(2)20(28)9-10-22(26)25(15,4)14-30-19-8-6-18-7-11-24(29)32-21(18)13-19/h6-8,11,13,15-16,22-23H,9-10,12,14H2,1-5H3/t15-,16+,22+,23-,25+,26-/m1/s1
Canonical SMILES
CC(=O)OC1CC(C)C(C)(COc2ccc3ccc(=O)oc3c2)C2CCC(=O)C(C)C12C
Isomeric SMILES
C[C@@H]1C[C@H]([C@@]2([C@H](C(=O)CC[C@H]2[C@@]1(C)COC3=CC4=C(C=C3)C=CC(=O)O4)C)C)OC(=O)C

Synonyms

  • ((1R,3R,4S,4aS,8R,8aS)-3,4,8,8a-tetramethyl-7-oxo-4-((2-oxochromen-7-yl)oxymethyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-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
440.54 g/molcalc.
Exact mass
440.2199 Dacalc.
LogP (octanol/water)
4.77calc.
Topological polar surface area
82.81 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
4calc.
Heavy atoms
32calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.58calc.
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=C1CCC2C(COc3ccc4ccc(=O)oc4c3)CCCC2C1

O=C1CCC2C(COc3ccc4ccc(=O)oc4c3)CCCC2C1

4 rings, 24 atoms.

2 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.

Microlobin suppliers

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Microlobin 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 Microlobin is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Microlobin?

Microlobin has been reported in Ferula assa-foetida, Ferula szowitziana, and Ferula microloba.

What is the CAS number of Microlobin?

The CAS registry number of Microlobin is 89803-98-5.

What is the molecular formula and weight of Microlobin?

The molecular formula of Microlobin is C26H32O6 and its molar mass is 440.54 g/mol.

What is Microlobin used for?

Known uses and roles of Microlobin include cooling agents in flavors and fragrances, building blocks in research and laboratory and screening compounds in research and laboratory.

Is Microlobin hazardous?

No GHS hazard classification for Microlobin 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 Microlobin?

Microlobin is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Microlobin?

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

What is the price of Microlobin?

Suppliers quote Microlobin 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 Microlobin

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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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