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Screening compounds

12-Deoxyphorbol

Also known as 4a,7b,9a-Trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-5H-cyclopropa[3,4]benzo[1,2-e]azulen-5-one

CAS 25090-75-9Formula C20H28O5Molar mass 348.44 g/mol
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12-Deoxyphorbol chemical structure, C20H28O5, CAS 25090-75-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
25090-75-9
Formula
C20H28O5
Molar mass
348.44 g/mol
HS code
291440
Category
Screening compounds

What is 12-Deoxyphorbol?

Plain description, key identifiers and synonyms

12-Deoxyphorbol has been reported in Euphorbia resinifera.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,2S,6R,10S,11R,13S,15R)-1,6,13-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyltetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dien-5-one
CAS number
25090-75-9 CAS number cross-checked
Molecular formula
C20H28O5
InChIKey
CBDIJHBGVGPIIE-MCDHERAVSA-N
InChI
InChI=1S/C20H28O5/c1-10-5-14-18(23,16(10)22)8-12(9-21)6-13-15-17(3,4)19(15,24)7-11(2)20(13,14)25/h5-6,11,13-15,21,23-25H,7-9H2,1-4H3/t11-,13+,14-,15-,18-,19+,20-/m1/s1
Canonical SMILES
CC1=CC2C(O)(CC(CO)=CC3C4C(C)(C)C4(O)CC(C)C32O)C1=O
Isomeric SMILES
C[C@@H]1C[C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)CO)O)C)O)O

Synonyms

  • 4a,7b,9a-Trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-5H-cyclopropa[3,4]benzo[1,2-e]azulen-5-one

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
348.44 g/molcalc.
Exact mass
348.1937 Dacalc.
LogP (octanol/water)
0.96calc.
Topological polar surface area
97.99 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
1calc.
Heavy atoms
25calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.75calc.
Formal charge
0calc.
Stereocentres
7calc.
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=C1C=CC2C1CC=CC1C3CC3CCC21

O=C1C=CC2C1CC=CC1C3CC3CCC21

4 rings, 16 atoms.

136 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.

12-Deoxyphorbol suppliers

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12-Deoxyphorbol 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 12-Deoxyphorbol is traded under.

HS 2914.40Indicative HS code

Ketone-alcohols and ketone-aldehydes

World exports in 2024
$199M
+2.5% vs 2023, imports $247M
2019 to 2024
Top exporters
  1. China29.5%
  2. Germany14.4%
  3. Netherlands12.7%
Top importers
  1. United States37.2%
  2. Netherlands8.5%
  3. Germany6.4%
Reported customs values in USD, not prices.Full trade data

The HS code shown for 12-Deoxyphorbol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 12-Deoxyphorbol, based on the data on this page

What is 12-Deoxyphorbol?

12-Deoxyphorbol has been reported in Euphorbia resinifera.

What is the CAS number of 12-Deoxyphorbol?

The CAS registry number of 12-Deoxyphorbol is 25090-75-9.

What is the molecular formula and weight of 12-Deoxyphorbol?

The molecular formula of 12-Deoxyphorbol is C20H28O5 and its molar mass is 348.44 g/mol.

What is 12-Deoxyphorbol used for?

Known uses and roles of 12-Deoxyphorbol include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 12-Deoxyphorbol hazardous?

No GHS hazard classification for 12-Deoxyphorbol 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 12-Deoxyphorbol?

12-Deoxyphorbol is usually classified under HS code 291440 (Ketone-alcohols and ketone-aldehydes). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 12-Deoxyphorbol?

Post a free request on CompoundList and suppliers of 12-Deoxyphorbol will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 12-Deoxyphorbol?

Suppliers quote 12-Deoxyphorbol 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 12-Deoxyphorbol

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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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