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Screening compounds

MappiodosideA

Also known as Mappiodoside A

CAS 1572084-11-7Formula C28H38N2O11Molar mass 578.62 g/mol
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MappiodosideA chemical structure, C28H38N2O11, CAS 1572084-11-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1572084-11-7
Formula
C28H38N2O11
Molar mass
578.62 g/mol
HS code
293499
Category
Screening compounds

What is MappiodosideA?

Plain description, key identifiers and synonyms

MappiodosideA is a chemical substance with the molecular formula C28H38N2O11 and a molar mass of 578.62 g/mol. Its CAS registry number is 1572084-11-7. The IUPAC name is (2S,3S,6S,12bS)-3-ethyl-2-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S,3S,6S,12bS)-3-ethyl-2-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylic acid
CAS number
1572084-11-7
Molecular formula
C28H38N2O11
InChIKey
DBNLWFJGEHSRPX-SCDBEMTMSA-N
InChI
InChI=1S/C28H38N2O11/c1-3-12-9-30-19(7-14(12)17(10-31)27(38)39-2)22-16(8-20(30)26(36)37)15-6-13(4-5-18(15)29-22)40-28-25(35)24(34)23(33)21(11-32)41-28/h4-6,12,14,17,19-21,23-25,28-29,31-35H,3,7-11H2,1-2H3,(H,36,37)/t12-,14+,17?,19+,20+,21-,23-,24+,25-,28-/m1/s1
Canonical SMILES
CCC1CN2C(C(=O)O)Cc3c([nH]c4ccc(OC5OC(CO)C(O)C(O)C5O)cc34)C2CC1C(CO)C(=O)OC
Isomeric SMILES
CC[C@@H]1CN2[C@@H](C[C@@H]1C(CO)C(=O)OC)C3=C(C[C@H]2C(=O)O)C4=C(N3)C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O

Synonyms

  • Mappiodoside A

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
578.62 g/molcalc.
Exact mass
578.2476 Dacalc.
LogP (octanol/water)
-0.47calc.
Topological polar surface area
202.2 Ųcalc.
Hydrogen bond donors
7calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
8calc.
Heavy atoms
41calc.
Rings
5calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.64calc.
Formal charge
0calc.
Stereocentres
10calc.
Lipinski rule of five
Fails (3 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, c1cc2[nH]c3c(c2cc1OC1CCCCO1)CCN1CCCCC31

c1cc2[nH]c3c(c2cc1OC1CCCCO1)CCN1CCCCC31

5 rings, 24 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.

MappiodosideA suppliers

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MappiodosideA 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 MappiodosideA is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is MappiodosideA?

MappiodosideA is a chemical substance with the molecular formula C28H38N2O11 and a molar mass of 578.62 g/mol. Its CAS registry number is 1572084-11-7.

What is the CAS number of MappiodosideA?

The CAS registry number of MappiodosideA is 1572084-11-7.

What is the molecular formula and weight of MappiodosideA?

The molecular formula of MappiodosideA is C28H38N2O11 and its molar mass is 578.62 g/mol.

What is MappiodosideA used for?

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

Is MappiodosideA hazardous?

No GHS hazard classification for MappiodosideA 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 MappiodosideA?

MappiodosideA is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy MappiodosideA?

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

What is the price of MappiodosideA?

Suppliers quote MappiodosideA 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 MappiodosideA

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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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