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Screening compounds

Subcordatolide E

Also known as [(3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-8-yl] 2-methylpropanoate, ((3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo(f)(1)benzofuran-8-yl) 2-methylpropanoate, (3aR,4aS,8R,8aR,9aS)-5,8a-Dimethyl-3-methylidene-2-oxo-2,3,3a,4,4a,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylpropanoate

CAS 111625-65-1Formula C19H26O4Molar mass 318.41 g/mol
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Subcordatolide E chemical structure, C19H26O4, CAS 111625-65-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
111625-65-1
Formula
C19H26O4
Molar mass
318.41 g/mol
HS code
293220
Category
Screening compounds

What is Subcordatolide E?

Plain description, key identifiers and synonyms

Subcordatolide E is a chemical substance with the molecular formula C19H26O4 and a molar mass of 318.41 g/mol. Its CAS registry number is 111625-65-1. The IUPAC name is [(3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-8-yl] 2-methylpropanoate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-8-yl] 2-methylpropanoate
CAS number
111625-65-1 CAS number cross-checked
Molecular formula
C19H26O4
InChIKey
RPBYSCRNRSFQDZ-LAIHZFQQSA-N
InChI
InChI=1S/C19H26O4/c1-10(2)17(20)23-16-7-6-11(3)14-8-13-12(4)18(21)22-15(13)9-19(14,16)5/h6,10,13-16H,4,7-9H2,1-3,5H3/t13-,14+,15+,16-,19-/m1/s1
Canonical SMILES
C=C1C(=O)OC2CC3(C)C(OC(=O)C(C)C)CC=C(C)C3CC12
Isomeric SMILES
CC1=CC[C@H]([C@]2([C@H]1C[C@H]3[C@H](C2)OC(=O)C3=C)C)OC(=O)C(C)C

Synonyms

  • [(3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-8-yl] 2-methylpropanoate
  • ((3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo(f)(1)benzofuran-8-yl) 2-methylpropanoate
  • (3aR,4aS,8R,8aR,9aS)-5,8a-Dimethyl-3-methylidene-2-oxo-2,3,3a,4,4a,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl 2-methylpropanoate

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
318.41 g/molcalc.
Exact mass
318.1831 Dacalc.
LogP (octanol/water)
3.42calc.
Topological polar surface area
52.6 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
2calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.68calc.
Formal charge
0calc.
Stereocentres
5calc.
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, C=C1C(=O)OC2CC3CCC=CC3CC12

C=C1C(=O)OC2CC3CCC=CC3CC12

3 rings, 15 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.

Subcordatolide E suppliers

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Subcordatolide E 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 Subcordatolide E 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 Subcordatolide E is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Subcordatolide E, based on the data on this page

What is Subcordatolide E?

Subcordatolide E is a chemical substance with the molecular formula C19H26O4 and a molar mass of 318.41 g/mol. Its CAS registry number is 111625-65-1. The IUPAC name is [(3aR,4aS,8R,8aR,9aS)-5,8a-dimethyl-3-methylidene-2-oxo-4,4a,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-8-yl] 2-methylpropanoate.

What is the CAS number of Subcordatolide E?

The CAS registry number of Subcordatolide E is 111625-65-1.

What is the molecular formula and weight of Subcordatolide E?

The molecular formula of Subcordatolide E is C19H26O4 and its molar mass is 318.41 g/mol.

What is Subcordatolide E used for?

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

Is Subcordatolide E hazardous?

No GHS hazard classification for Subcordatolide E 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 Subcordatolide E?

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

Where can I buy Subcordatolide E?

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

What is the price of Subcordatolide E?

Suppliers quote Subcordatolide E 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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