CompoundList

Neomangiferin

Also known as Mangiferin-7-O-beta-glucoside, 9H-Xanthen-9-one, 2-beta-D-glucopyranosyl-7-(beta-D-glucopyranosyloxy)-1,3,6-trihydroxy-, 7-O-beta-D-glucopyranosyl-mangiferin

Neomangiferin chemical structure, C25H28O16, CAS 64809-67-2
2D chemical structure

Key facts

What buyers check first

CAS number
64809-67-2
Formula
C25H28O16
Molar mass
584.48 g/mol
EC number
613-694-0
HS code
294000
Category
Carbohydrates and sugars

What is Neomangiferin?

Plain description, key identifiers and synonyms

Neomangiferin is a member of xanthones.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1,3,6-trihydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
CAS number
64809-67-2
EC number
613-694-0
Molecular formula
C25H28O16
MDL number
MFCD04034741
InChIKey
VUWOVGXVRYBSGI-IRXABLMPSA-N
InChI
InChI=1S/C25H28O16/c26-4-12-17(31)20(34)22(36)24(39-12)14-8(29)3-11-15(19(14)33)16(30)6-1-10(7(28)2-9(6)38-11)40-25-23(37)21(35)18(32)13(5-27)41-25/h1-3,12-13,17-18,20-29,31-37H,4-5H2/t12-,13-,17-,18-,20+,21+,22-,23-,24+,25-/m1/s1
Canonical SMILES
O=c1c2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12
Isomeric SMILES
C1=C2C(=CC(=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)OC4=C(C2=O)C(=C(C(=C4)O)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

Synonyms

  • Mangiferin-7-O-beta-glucoside
  • 9H-Xanthen-9-one, 2-beta-D-glucopyranosyl-7-(beta-D-glucopyranosyloxy)-1,3,6-trihydroxy-
  • 7-O-beta-D-glucopyranosyl-mangiferin
  • neomangferin
  • Neomangiferin (Standard)
  • 2-(b-D-Glucopyranosyl)-7-(b-D-glucopyranosyloxy)-1,3,6-trihydroxy-9H-xanthen-9-one
  • 1,3,6-trihydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-
  • (1S)-1,5-Anhydro-1-[7-(beta-D-glucopyranosyloxy)-1,3,6-trihydroxy-9-oxo-9H-xanthen-2-yl]-D-glucitol

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
584.48 g/molcalc.
Exact mass
584.1377 Dacalc.
LogP (octanol/water)
-3.24calc.
Topological polar surface area
280.4 Ųcalc.
Hydrogen bond donors
11calc.
Hydrogen bond acceptors
16calc.
Rotatable bonds
5calc.
Heavy atoms
41calc.
Rings
5calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.48calc.
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, O=c1c2cc(OC3CCCCO3)ccc2oc2ccc(C3CCCCO3)cc12

O=c1c2cc(OC3CCCCO3)ccc2oc2ccc(C3CCCCO3)cc12

5 rings, 28 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Danger
GHS06: Acute toxicity (severe)
Acute toxicity (severe)

Hazard statements

  • H300Fatal if swallowed.
Precautionary statements (7)
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P301 + P316If swallowed: Get emergency medical help immediately.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • 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

Neomangiferin suppliers

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All 3 suppliers

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Where suppliers are based

3 suppliers in 1 country

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Neomangiferin 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 Neomangiferin is traded under.

HS 2940.00Indicative HS code

Sugar ethers, sugar acetals and sugar esters, and their salts, other than the products of heading 29.37…

World exports in 2024
$1.4B
−5.4% vs 2023, imports $1.42B
2019 to 2024
Top exporters
  1. Germany23.7%
  2. China20.6%
  3. United States11.5%
Top importers
  1. United States14.0%
  2. Japan7.4%
  3. Germany6.1%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Neomangiferin?

Neomangiferin is a member of xanthones.

What is the CAS number of Neomangiferin?

The CAS registry number of Neomangiferin is 64809-67-2.

What is the molecular formula and weight of Neomangiferin?

The molecular formula of Neomangiferin is C25H28O16 and its molar mass is 584.48 g/mol.

Is Neomangiferin hazardous?

Neomangiferin carries the GHS signal word "Danger". Main hazards: fatal if swallowed. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Neomangiferin?

Neomangiferin is usually classified under HS code 294000 (Sugars, chemically pure, other than sucrose, lactose, maltose, glucose and fructose…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Neomangiferin?

CompoundList lists 3 suppliers of Neomangiferin in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Neomangiferin?

Suppliers quote Neomangiferin 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 Neomangiferin

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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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