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Screening compounds

Orb1700940

Formula C24H40O5Molar mass 408.58 g/mol
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Orb1700940 chemical structure, C24H40O5
2D chemical structure

Key facts

What buyers check first

All properties
Formula
C24H40O5
Molar mass
408.58 g/mol
HS code
291899
Category
Screening compounds

What is Orb1700940?

Plain description, key identifiers and synonyms

Orb1700940 is a chemical substance with the molecular formula C24H40O5 and a molar mass of 408.58 g/mol. The IUPAC name is methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]heptanoate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]heptanoate
Molecular formula
C24H40O5
InChIKey
XRISENIKJUKIHD-IOOSKWMSSA-N
InChI
InChI=1S/C24H40O5/c1-3-14-24(15-9-16-24)22(27)12-8-11-19-18(20(25)17-21(19)26)10-6-4-5-7-13-23(28)29-2/h8,11,18-19,21-22,26-27H,3-7,9-10,12-17H2,1-2H3/b11-8+/t18-,19-,21-,22+/m1/s1
Canonical SMILES
CCCC1(C(O)CC=CC2C(O)CC(=O)C2CCCCCCC(=O)OC)CCC1
Isomeric SMILES
CCCC1(CCC1)[C@H](C/C=C/[C@H]2[C@@H](CC(=O)[C@@H]2CCCCCCC(=O)OC)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
408.58 g/molcalc.
Exact mass
408.2876 Dacalc.
LogP (octanol/water)
4.34calc.
Topological polar surface area
83.83 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
13calc.
Heavy atoms
29calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.83calc.
Formal charge
0calc.
Stereocentres
4calc.
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=C1CCC(C=CCCC2CCC2)C1

O=C1CCC(C=CCCC2CCC2)C1

2 rings, 14 atoms.

7 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.

Orb1700940 suppliers

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Orb1700940 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 Orb1700940 is traded under.

HS 2918.99Indicative HS code

Carboxylic acids, with additional oxygen function (not alcohol, phenol, aldehyde or ketone)…

World exports in 2024
$1.46B
−1.1% vs 2023, imports $1.54B
2019 to 2024
Top exporters
  1. China40.0%
  2. India * partner reported26.6%
  3. Germany8.0%
Top importers
  1. United States25.6%
  2. Brazil6.7%
  3. Argentina5.9%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb1700940 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb1700940, based on the data on this page

What is Orb1700940?

Orb1700940 is a chemical substance with the molecular formula C24H40O5 and a molar mass of 408.58 g/mol. The IUPAC name is methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,4S)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]heptanoate.

What is the molecular formula and weight of Orb1700940?

The molecular formula of Orb1700940 is C24H40O5 and its molar mass is 408.58 g/mol.

What is Orb1700940 used for?

Known uses and roles of Orb1700940 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Orb1700940 hazardous?

No GHS hazard classification for Orb1700940 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 Orb1700940?

Orb1700940 is usually classified under HS code 291899 (Carboxylic acids with additional oxygen function and their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb1700940?

Post a free request on CompoundList and suppliers of Orb1700940 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb1700940?

Suppliers quote Orb1700940 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 Orb1700940

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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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