CompoundList

Crassumolide E

Also known as (3aR,5E,9E,13E,15aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca(b)furan-14-carboxylic acid, (3aR,5E,9E,13E,15aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca[b]furan-14-carboxylic acid, (1S,2E,6E,9E,11R,14S)-11-hydroperoxy-14-(3-hydroxyprop-1-en-2-yl)-3,7,11-trimethylcyclotetradeca-2,6,9-trien-1-ol

CAS 1086338-89-7Formula C20H32O4Molar mass 336.47 g/mol
Crassumolide E chemical structure, C20H32O4, CAS 1086338-89-7
2D chemical structure

Key facts

What buyers check first

CAS number
1086338-89-7
Formula
C20H32O4
Molar mass
336.47 g/mol
HS code
290960
Category
Initiators, curing agents and crosslinkers

What is Crassumolide E?

Plain description, key identifiers and synonyms

crassumolide E has been reported in Lobophytum crassum.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,2E,6E,9E,11R,14S)-11-hydroperoxy-14-(3-hydroxyprop-1-en-2-yl)-3,7,11-trimethylcyclotetradeca-2,6,9-trien-1-ol
CAS number
1086338-89-7
Molecular formula
C20H32O4
InChIKey
HGPWGHBBMMTDTA-WWWHTDTNSA-N
InChI
InChI=1S/C20H32O4/c1-15-7-5-8-16(2)13-19(22)18(17(3)14-21)10-12-20(4,24-23)11-6-9-15/h6-7,11,13,18-19,21-23H,3,5,8-10,12,14H2,1-2,4H3/b11-6+,15-7+,16-13+/t18-,19-,20-/m0/s1
Canonical SMILES
C=C(CO)C1CCC(C)(OO)C=CCC(C)=CCCC(C)=CC1O
Isomeric SMILES
C/C/1=C\[C@@H]([C@@H](CC[C@@](/C=C/C/C(=C/CC1)/C)(C)OO)C(=C)CO)O

Synonyms

  • (3aR,5E,9E,13E,15aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca(b)furan-14-carboxylic acid
  • (3aR,5E,9E,13E,15aS)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,7,8,11,12,15,15a-octahydrocyclotetradeca[b]furan-14-carboxylic acid
  • (1S,2E,6E,9E,11R,14S)-11-hydroperoxy-14-(3-hydroxyprop-1-en-2-yl)-3,7,11-trimethylcyclotetradeca-2,6,9-trien-1-ol

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
336.47 g/molcalc.
Exact mass
336.2301 Dacalc.
LogP (octanol/water)
4.17calc.
Topological polar surface area
69.92 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
24calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.6calc.
Formal charge
0calc.
Stereocentres
3calc.
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, C1=CCCC=CCCCCCC=CC1

C1=CCCC=CCCCCCC=CC1

1 ring, 14 atoms.

No other chemical in our database has 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.

Crassumolide E suppliers

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Crassumolide E price

Indicative price range per kg from live supplier offers

No published prices right now

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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 Crassumolide E is traded under.

HS 2909.60Indicative HS code

Alcohol peroxides, ether peroxides, acetal and hemiacetal peroxides, ketone peroxides…

World exports in 2024
$498M
−0.2% vs 2023, imports $522M
2019 to 2024
Top exporters
  1. China46.5%
  2. Germany16.2%
  3. United States10.1%
Top importers
  1. United States11.4%
  2. Germany8.4%
  3. South Korea7.3%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Crassumolide E?

crassumolide E has been reported in Lobophytum crassum.

What is the CAS number of Crassumolide E?

The CAS registry number of Crassumolide E is 1086338-89-7.

What is the molecular formula and weight of Crassumolide E?

The molecular formula of Crassumolide E is C20H32O4 and its molar mass is 336.47 g/mol.

What is Crassumolide E used for?

Known uses and roles of Crassumolide E include initiators and catalysts in plastics and polymers and curing agents and crosslinkers in plastics and polymers.

Is Crassumolide E hazardous?

No GHS hazard classification for Crassumolide 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 Crassumolide E?

Crassumolide E is usually classified under HS code 290960 (Alcohol peroxides, ether peroxides, acetal and hemiacetal peroxides, ketone peroxides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Crassumolide E?

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

What is the price of Crassumolide E?

Suppliers quote Crassumolide 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

Practical guides that help when you source, ship or handle Crassumolide E

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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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