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Glycosides and other natural products

(+)-Propranolol glucuronide

Also known as (R)-Propranolol glucuronide, Propranolol glucuronide, (+)-, (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl)oxyoxane-2-carboxylic acid

CAS 58657-79-7Formula C22H29NO8Molar mass 435.47 g/mol
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(+)-Propranolol glucuronide chemical structure, C22H29NO8, CAS 58657-79-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
58657-79-7
Formula
C22H29NO8
Molar mass
435.47 g/mol
HS code
293890
Category
Glycosides and other natural products

What is (+)-Propranolol glucuronide?

Plain description, key identifiers and synonyms

(+)-Propranolol glucuronide is a chemical substance with the molecular formula C22H29NO8 and a molar mass of 435.47 g/mol. Its CAS registry number is 58657-79-7. The IUPAC name is (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl]oxyoxane-2-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl]oxyoxane-2-carboxylic acid
CAS number
58657-79-7
Molecular formula
C22H29NO8
UNII
A6A3HG2GX5
MDL number
MFCD19705049
InChIKey
PCALHJGQCKATMK-CYCKLWOHSA-N
InChI
InChI=1S/C22H29NO8/c1-12(2)23-10-14(11-29-16-9-5-7-13-6-3-4-8-15(13)16)30-22-19(26)17(24)18(25)20(31-22)21(27)28/h3-9,12,14,17-20,22-26H,10-11H2,1-2H3,(H,27,28)/t14-,17+,18+,19-,20+,22-/m1/s1
Canonical SMILES
CC(C)NCC(COc1cccc2ccccc12)OC1OC(C(=O)O)C(O)C(O)C1O
Isomeric SMILES
CC(C)NC[C@H](COC1=CC=CC2=CC=CC=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O

Synonyms

  • (R)-Propranolol glucuronide
  • Propranolol glucuronide, (+)-
  • (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-((2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl)oxyoxane-2-carboxylic acid
  • (1R)-1-(((1-Methylethyl)amino)methyl)-2-(1-naphthalenyloxy)ethyl beta-d-glucopyranosiduronic acid
  • (2R)-1-[(Naphthalen-1-yl)oxy]-3-[(propan-2-yl)amino]propan-2-yl beta-D-glucopyranosiduronic acid
  • (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(1R)-1-[(isopropylamino)methyl]-2-(1-naphthyloxy)ethoxy]tetrahydropyran-2-carboxylic acid
  • beta-d-glucopyranosiduronic acid, (1R)-1-(((1-methylethyl)amino)methyl)-2-(1-naphthalenyloxy)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
435.47 g/molcalc.
Exact mass
435.1893 Dacalc.
LogP (octanol/water)
0.49calc.
Topological polar surface area
137.7 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
9calc.
Heavy atoms
31calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.5calc.
Formal charge
0calc.
Stereocentres
6calc.
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, c1ccc2c(OCCOC3CCCCO3)cccc2c1

c1ccc2c(OCCOC3CCCCO3)cccc2c1

3 rings, 20 atoms.

9 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.

(+)-Propranolol glucuronide suppliers

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Where suppliers are based

1 supplier in 1 country

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(+)-Propranolol glucuronide 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 (+)-Propranolol glucuronide 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 (+)-Propranolol glucuronide is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about (+)-Propranolol glucuronide, based on the data on this page

What is (+)-Propranolol glucuronide?

(+)-Propranolol glucuronide is a chemical substance with the molecular formula C22H29NO8 and a molar mass of 435.47 g/mol. Its CAS registry number is 58657-79-7. The IUPAC name is (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl]oxyoxane-2-carboxylic acid.

What is the CAS number of (+)-Propranolol glucuronide?

The CAS registry number of (+)-Propranolol glucuronide is 58657-79-7.

What is the molecular formula and weight of (+)-Propranolol glucuronide?

The molecular formula of (+)-Propranolol glucuronide is C22H29NO8 and its molar mass is 435.47 g/mol.

Is (+)-Propranolol glucuronide hazardous?

No GHS hazard classification for (+)-Propranolol glucuronide 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 (+)-Propranolol glucuronide?

(+)-Propranolol glucuronide 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 (+)-Propranolol glucuronide?

CompoundList lists 1 supplier of (+)-Propranolol glucuronide in United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of (+)-Propranolol glucuronide?

Suppliers quote (+)-Propranolol glucuronide 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 (+)-Propranolol glucuronide

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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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