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Screening compounds

Emoghrelin

Also known as Emodin 8-O-beta-D-(6'-O-Malonylglucoside), 8-[[6-O-(2-Carboxyacetyl)-beta-D-glucopyranosyl]oxy]-1,6-dihydroxy-3-methyl-9,10-anthracenedione, Emodin 8-O-beta-D-(6 inverted exclamation mark -O-Malonylglucoside)

CAS 928262-58-2Formula C24H22O13Molar mass 518.43 g/mol
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Emoghrelin chemical structure, C24H22O13, CAS 928262-58-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
928262-58-2
Formula
C24H22O13
Molar mass
518.43 g/mol
HS code
293299
Category
Screening compounds

What is Emoghrelin?

Plain description, key identifiers and synonyms

Emoghrelin is a chemical substance with the molecular formula C24H22O13 and a molar mass of 518.43 g/mol. Its CAS registry number is 928262-58-2. The IUPAC name is 3-[[(2R,3S,4S,5R,6S)-6-(3,8-dihydroxy-6-methyl-9,10-dioxoanthracen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[[(2R,3S,4S,5R,6S)-6-(3,8-dihydroxy-6-methyl-9,10-dioxoanthracen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid
CAS number
928262-58-2
Molecular formula
C24H22O13
InChIKey
ARYOUUYBGPNODI-LHNXKRSWSA-N
InChI
InChI=1S/C24H22O13/c1-8-2-10-17(12(26)3-8)21(32)18-11(19(10)30)4-9(25)5-13(18)36-24-23(34)22(33)20(31)14(37-24)7-35-16(29)6-15(27)28/h2-5,14,20,22-26,31,33-34H,6-7H2,1H3,(H,27,28)/t14-,20-,22+,23-,24-/m1/s1
Canonical SMILES
Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(OC3OC(COC(=O)CC(=O)O)C(O)C(O)C3O)c1C2=O
Isomeric SMILES
CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)CC(=O)O)O)O)O)O

Synonyms

  • Emodin 8-O-beta-D-(6'-O-Malonylglucoside)
  • 8-[[6-O-(2-Carboxyacetyl)-beta-D-glucopyranosyl]oxy]-1,6-dihydroxy-3-methyl-9,10-anthracenedione
  • Emodin 8-O-beta-D-(6 inverted exclamation mark -O-Malonylglucoside)
  • Emodin8-O-|A-D-(6 inverted exclamation mark -O-Malonylglucoside)
  • 3-[[(2R,3S,4S,5R,6S)-6-(3,8-dihydroxy-6-methyl-9,10-dioxoanthracen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid
  • 8-[[6-O-(2-Carboxyacetyl)-ss-D-glucopyranosyl]oxy]-1,6-dihydroxy-3-methyl-9,10-anthracenedione

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
518.43 g/molcalc.
Exact mass
518.106 Dacalc.
LogP (octanol/water)
-0.61calc.
Topological polar surface area
217.4 Ųcalc.
Hydrogen bond donors
6calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
6calc.
Heavy atoms
37calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
5calc.
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=C1c2ccccc2C(=O)c2c(OC3CCCCO3)cccc21

O=C1c2ccccc2C(=O)c2c(OC3CCCCO3)cccc21

4 rings, 23 atoms.

25 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.

Emoghrelin suppliers

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Emoghrelin 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 Emoghrelin is traded under.

HS 2932.99Indicative HS code

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

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Emoghrelin?

Emoghrelin is a chemical substance with the molecular formula C24H22O13 and a molar mass of 518.43 g/mol. Its CAS registry number is 928262-58-2. The IUPAC name is 3-[[(2R,3S,4S,5R,6S)-6-(3,8-dihydroxy-6-methyl-9,10-dioxoanthracen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid.

What is the CAS number of Emoghrelin?

The CAS registry number of Emoghrelin is 928262-58-2.

What is the molecular formula and weight of Emoghrelin?

The molecular formula of Emoghrelin is C24H22O13 and its molar mass is 518.43 g/mol.

What is Emoghrelin used for?

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

Is Emoghrelin hazardous?

No GHS hazard classification for Emoghrelin 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 Emoghrelin?

Emoghrelin is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Emoghrelin?

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

What is the price of Emoghrelin?

Suppliers quote Emoghrelin 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

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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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