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Screening compounds

MappiodineA

Also known as Mappiodine A

CAS 1572084-08-2Formula C22H28N2O6Molar mass 416.47 g/mol
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MappiodineA chemical structure, C22H28N2O6, CAS 1572084-08-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1572084-08-2
Formula
C22H28N2O6
Molar mass
416.47 g/mol
HS code
293399
Category
Screening compounds

What is MappiodineA?

Plain description, key identifiers and synonyms

MappiodineA is a chemical substance with the molecular formula C22H28N2O6 and a molar mass of 416.47 g/mol. Its CAS registry number is 1572084-08-2. The IUPAC name is (2S,3S,6S,12bS)-3-ethyl-9-hydroxy-2-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-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-9-hydroxy-2-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylic acid
CAS number
1572084-08-2
Molecular formula
C22H28N2O6
InChIKey
KDJXZMQKERUMAG-BRURFJDNSA-N
InChI
InChI=1S/C22H28N2O6/c1-3-11-9-24-18(7-13(11)16(10-25)22(29)30-2)20-15(8-19(24)21(27)28)14-6-12(26)4-5-17(14)23-20/h4-6,11,13,16,18-19,23,25-26H,3,7-10H2,1-2H3,(H,27,28)/t11-,13+,16?,18+,19+/m1/s1
Canonical SMILES
CCC1CN2C(C(=O)O)Cc3c([nH]c4ccc(O)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

Synonyms

  • Mappiodine 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
416.47 g/molcalc.
Exact mass
416.1947 Dacalc.
LogP (octanol/water)
2.05calc.
Topological polar surface area
123.1 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
5calc.
Heavy atoms
30calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.55calc.
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, c1ccc2c3c([nH]c2c1)C1CCCCN1CC3

c1ccc2c3c([nH]c2c1)C1CCCCN1CC3

4 rings, 17 atoms, the 1,2,3,4,6,7,12,12b-Octahydroindolo(2,3-a)quinolizine ring system.

58 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.

MappiodineA suppliers

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MappiodineA 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 MappiodineA is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is MappiodineA?

MappiodineA is a chemical substance with the molecular formula C22H28N2O6 and a molar mass of 416.47 g/mol. Its CAS registry number is 1572084-08-2. The IUPAC name is (2S,3S,6S,12bS)-3-ethyl-9-hydroxy-2-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-6-carboxylic acid.

What is the CAS number of MappiodineA?

The CAS registry number of MappiodineA is 1572084-08-2.

What is the molecular formula and weight of MappiodineA?

The molecular formula of MappiodineA is C22H28N2O6 and its molar mass is 416.47 g/mol.

What is MappiodineA used for?

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

Is MappiodineA hazardous?

No GHS hazard classification for MappiodineA 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 MappiodineA?

MappiodineA is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy MappiodineA?

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

What is the price of MappiodineA?

Suppliers quote MappiodineA 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 MappiodineA

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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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