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Glycosides and other natural products

14-Deoxyandrographoside

Also known as Ninandrographolide, andropanoside, deoxyandrographiside

CAS 82209-72-1Formula C26H40O9Molar mass 496.60 g/mol
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14-Deoxyandrographoside chemical structure, C26H40O9, CAS 82209-72-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
82209-72-1
Formula
C26H40O9
Molar mass
496.60 g/mol
HS code
293890
Category
Glycosides and other natural products

What is 14-Deoxyandrographoside?

Plain description, key identifiers and synonyms

ninandrographolide has been reported in Andrographis paniculata.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-[2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one
CAS number
82209-72-1
Molecular formula
C26H40O9
UNII
Z87B39FVT4
InChIKey
MEEPUSVTMHGIPC-MVGASCEISA-N
InChI
InChI=1S/C26H40O9/c1-14-4-7-18-25(2,16(14)6-5-15-9-11-33-23(15)32)10-8-19(28)26(18,3)13-34-24-22(31)21(30)20(29)17(12-27)35-24/h9,16-22,24,27-31H,1,4-8,10-13H2,2-3H3/t16-,17-,18+,19-,20-,21+,22-,24-,25+,26+/m1/s1
Canonical SMILES
C=C1CCC2C(C)(COC3OC(CO)C(O)C(O)C3O)C(O)CCC2(C)C1CCC1=CCOC1=O
Isomeric SMILES
C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2CCC3=CCOC3=O)(C)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

Synonyms

  • Ninandrographolide
  • andropanoside
  • deoxyandrographiside
  • deoxyandrographoside
  • (-)-Ninandrographolide
  • Deoxyandrographoside (Andrographoside, Ninandrographolide)
  • 2(5H)-furanone, 3-(2-((1R,4as,5R,6R,8as)-5-((beta-d-glucopyranosyloxy)methyl)decahydro-6-hydroxy-5,8a-dimethyl-2-methylene-1-naphthalenyl)ethyl)-

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
496.60 g/molcalc.
Exact mass
496.2672 Dacalc.
LogP (octanol/water)
0.82calc.
Topological polar surface area
145.9 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
7calc.
Heavy atoms
35calc.
Rings
4calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.81calc.
Formal charge
0calc.
Stereocentres
10calc.
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, C=C1CCC2C(COC3CCCCO3)CCCC2C1CCC1=CCOC1=O

C=C1CCC2C(COC3CCCCO3)CCCC2C1CCC1=CCOC1=O

4 rings, 27 atoms.

1 other chemical 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.

14-Deoxyandrographoside suppliers

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14-Deoxyandrographoside 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

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 14-Deoxyandrographoside is traded under.

HS 2938.90Indicative HS code

Natural or reproduced by synthesis, other than rutoside (rutin) and its derivatives

World exports in 2024
$1.4B
−8.3% vs 2023, imports $1.35B
2019 to 2024
Top exporters
  1. China49.2%
  2. France * partner reported8.9%
  3. Malaysia6.1%
Top importers
  1. United States22.3%
  2. India * partner reported7.8%
  3. Brazil5.5%

* Partner reported figures, a lower bound.

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

The HS code shown for 14-Deoxyandrographoside is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 14-Deoxyandrographoside, based on the data on this page

What is 14-Deoxyandrographoside?

ninandrographolide has been reported in Andrographis paniculata.

What is the CAS number of 14-Deoxyandrographoside?

The CAS registry number of 14-Deoxyandrographoside is 82209-72-1.

What is the molecular formula and weight of 14-Deoxyandrographoside?

The molecular formula of 14-Deoxyandrographoside is C26H40O9 and its molar mass is 496.60 g/mol.

Is 14-Deoxyandrographoside hazardous?

No GHS hazard classification for 14-Deoxyandrographoside 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 14-Deoxyandrographoside?

14-Deoxyandrographoside is usually classified under HS code 293890 (Glycosides, natural or reproduced by synthesis, and their salts, ethers, esters and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 14-Deoxyandrographoside?

Post a free request on CompoundList and suppliers of 14-Deoxyandrographoside will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 14-Deoxyandrographoside?

Suppliers quote 14-Deoxyandrographoside 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 14-Deoxyandrographoside

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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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