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Screening compounds

Orb3211784

CAS 1621682-24-3Formula C31H40O8Molar mass 540.65 g/mol
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Orb3211784 chemical structure, C31H40O8, CAS 1621682-24-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1621682-24-3
Formula
C31H40O8
Molar mass
540.65 g/mol
HS code
293219
Category
Screening compounds

What is Orb3211784?

Plain description, key identifiers and synonyms

Orb3211784 is a chemical substance with the molecular formula C31H40O8 and a molar mass of 540.65 g/mol. Its CAS registry number is 1621682-24-3. The IUPAC name is [(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-12-yl] 2-methylprop-2-enoate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-12-yl] 2-methylprop-2-enoate
CAS number
1621682-24-3
Molecular formula
C31H40O8
InChIKey
ZDPQOYFADWSMKK-PBQWSJDUSA-N
InChI
InChI=1S/C31H40O8/c1-15(2)28(34)39-22-12-21(32)29(4)14-37-25-26(29)30(22,5)20(11-23(33)35-7)31(6)24-16(3)18(17-8-9-36-13-17)10-19(24)38-27(25)31/h8-9,13,18-22,25-27,32H,1,10-12,14H2,2-7H3/t18-,19-,20-,21-,22+,25-,26+,27-,29-,30+,31-/m1/s1
Canonical SMILES
C=C(C)C(=O)OC1CC(O)C2(C)COC3C4OC5CC(c6ccoc6)C(C)=C5C4(C)C(CC(=O)OC)C1(C)C32
Isomeric SMILES
CC1=C2[C@@H](C[C@H]1C3=COC=C3)O[C@H]4[C@@]2([C@@H]([C@]5([C@H](C[C@H]([C@@]6([C@@H]5[C@H]4OC6)C)O)OC(=O)C(=C)C)C)CC(=O)OC)C

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
540.65 g/molcalc.
Exact mass
540.2723 Dacalc.
LogP (octanol/water)
4.33calc.
Topological polar surface area
104.4 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
5calc.
Heavy atoms
39calc.
Rings
6calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.68calc.
Formal charge
0calc.
Stereocentres
11calc.
Lipinski rule of five
Passes (1 violation)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, C1=C2C(CC1c1ccoc1)OC1C2CC2CCCC3COC1C32

C1=C2C(CC1c1ccoc1)OC1C2CC2CCCC3COC1C32

6 rings, 23 atoms.

15 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.

Orb3211784 suppliers

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Orb3211784 price

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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 Orb3211784 is traded under.

HS 2932.19Indicative HS code

Compounds containing an unfused furan ring (whether or not hydrogenated) in the…

World exports in 2024
$2.62B
−6.4% vs 2023, imports $2.56B
2019 to 2024
Top exporters
  1. Germany57.9%
  2. Italy11.5%
  3. China10.4%
Top importers
  1. Greece40.4%
  2. Japan16.3%
  3. Germany12.8%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Orb3211784 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb3211784, based on the data on this page

What is Orb3211784?

Orb3211784 is a chemical substance with the molecular formula C31H40O8 and a molar mass of 540.65 g/mol. Its CAS registry number is 1621682-24-3.

What is the CAS number of Orb3211784?

The CAS registry number of Orb3211784 is 1621682-24-3.

What is the molecular formula and weight of Orb3211784?

The molecular formula of Orb3211784 is C31H40O8 and its molar mass is 540.65 g/mol.

What is Orb3211784 used for?

Known uses and roles of Orb3211784 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb3211784 hazardous?

No GHS hazard classification for Orb3211784 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 Orb3211784?

Orb3211784 is usually classified under HS code 293219 (Compounds containing an unfused furan ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb3211784?

Post a free request on CompoundList and suppliers of Orb3211784 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb3211784?

Suppliers quote Orb3211784 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

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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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