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Fluorescent probes and labels

Sapintoxin d

Also known as phorbol 12-(2-methylamino)benzoate 13-acetate, 5,9,11-trihydroxyprosta-6E,14Z-dien-1-oate, 12-O-(N-Methylanthranilate) phorbol-13-acetate

CAS 80998-07-8Formula C30H37NO8Molar mass 539.63 g/molEC 635-962-6
GHS signal word: Warning. Pictograms: Harmful or irritant
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Sapintoxin d chemical structure, C30H37NO8, CAS 80998-07-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
80998-07-8
Formula
C30H37NO8
Molar mass
539.63 g/mol
EC number
635-962-6
HS code
292249
Category
Fluorescent probes and labels

What is Sapintoxin d?

Plain description, key identifiers and synonyms

Sapintoxin D is a phorbol ester consisting of phorbol that is acylated at positions 12 and 13 by 2-(methylamino)benzoyl and acetyl groups respectively. It has a role as a metabolite and a fluorescent probe. It is a tertiary alpha-hydroxy ketone and a phorbol ester.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2-(methylamino)benzoate
CAS number
80998-07-8 CAS number cross-checked
EC number
635-962-6
Molecular formula
C30H37NO8
UNII
8JH6F6D2ES
InChIKey
UPAIGGMQTARRMN-CSSCWBSHSA-N
InChI
InChI=1S/C30H37NO8/c1-15-11-22-28(36,24(15)34)13-18(14-32)12-20-23-27(4,5)30(23,39-17(3)33)25(16(2)29(20,22)37)38-26(35)19-9-7-8-10-21(19)31-6/h7-12,16,20,22-23,25,31-32,36-37H,13-14H2,1-6H3/t16-,20+,22-,23-,25-,28-,29-,30-/m1/s1
Canonical SMILES
CNc1ccccc1C(=O)OC1C(C)C2(O)C(C=C(CO)CC3(O)C(=O)C(C)=CC32)C2C(C)(C)C12OC(C)=O
Isomeric SMILES
C[C@@H]1[C@H]([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)OC(=O)C)OC(=O)C5=CC=CC=C5NC

Synonyms

  • phorbol 12-(2-methylamino)benzoate 13-acetate
  • 5,9,11-trihydroxyprosta-6E,14Z-dien-1-oate
  • 12-O-(N-Methylanthranilate) phorbol-13-acetate
  • 5,9,11-Trihydroxyprosta-6E,14Z-dien-1-Oic acid
  • Phorbol 12-(2-methylamino)benzoic acid 13-acetic acid

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
539.63 g/molcalc.
Exact mass
539.2519 Dacalc.
LogP (octanol/water)
2.41calc.
Topological polar surface area
142.4 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
5calc.
Heavy atoms
39calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.57calc.
Formal charge
0calc.
Stereocentres
8calc.
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, O=C(OC1CC2C3C=CC(=O)C3CC=CC2C2CC12)c1ccccc1

O=C(OC1CC2C3C=CC(=O)C3CC=CC2C2CC12)c1ccccc1

5 rings, 25 atoms.

6 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H315Causes skin irritation.
  • H319Causes serious eye irritation.
  • H335May cause respiratory irritation.
Precautionary statements (16)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P319Get medical help if you feel unwell.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P332 + P317If skin irritation occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P403 + P233Store in a well-ventilated place. Keep container tightly closed.
  • P405Store locked up.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

Sapintoxin d suppliers

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Sapintoxin d 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

Roles

  • fluorescent probe
  • metabolite
  • probe

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 Sapintoxin d is traded under.

HS 2922.49Indicative HS code

Amino-acids, other than those containing more than one kind of oxygen function, and…

World exports in 2024
$3.88B
−11.5% vs 2023, imports $3.87B
2019 to 2024
Top exporters
  1. China38.7%
  2. India * partner reported8.3%
  3. Germany8.1%
Top importers
  1. United States13.4%
  2. Germany11.1%
  3. Japan6.6%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Sapintoxin d, based on the data on this page

What is Sapintoxin d?

Sapintoxin D is a phorbol ester consisting of phorbol that is acylated at positions 12 and 13 by 2-(methylamino)benzoyl and acetyl groups respectively. It has a role as a metabolite and a fluorescent probe. It is a tertiary alpha-hydroxy ketone and a phorbol ester.

What is the CAS number of Sapintoxin d?

The CAS registry number of Sapintoxin d is 80998-07-8.

What is the molecular formula and weight of Sapintoxin d?

The molecular formula of Sapintoxin d is C30H37NO8 and its molar mass is 539.63 g/mol.

What is Sapintoxin d used for?

Known uses and roles of Sapintoxin d include cooling agents in flavors and fragrances, fluorescent probes in research and laboratory, fluorescent probe, metabolite and probe.

Is Sapintoxin d hazardous?

Sapintoxin d carries the GHS signal word "Warning". Main hazards: causes skin irritation, causes serious eye irritation, may cause respiratory irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Sapintoxin d?

Sapintoxin d is usually classified under HS code 292249 (Amino-acids, other than those containing more than one kind of oxygen function, and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Sapintoxin d?

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What is the price of Sapintoxin d?

Suppliers quote Sapintoxin d 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 Sapintoxin d

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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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