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Glycosides and other natural products

Globularin

Also known as ACon1_000554, beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-(((1-oxo-3-phenyl-2-propenyl)oxy)methyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl

CAS 1399-49-1Formula C24H28O11Molar mass 492.48 g/mol
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Globularin chemical structure, C24H28O11, CAS 1399-49-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1399-49-1
Formula
C24H28O11
Molar mass
492.48 g/mol
HS code
293890
Category
Glycosides and other natural products

What is Globularin?

Plain description, key identifiers and synonyms

Globularin has been reported in Penstemon glaber, Globularia orientalis, and other organisms.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1S,2S,4S,5S,6R,10S)-5-hydroxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl (E)-3-phenylprop-2-enoate
CAS number
1399-49-1Other or deprecated CAS: 58286-51-4
Molecular formula
C24H28O11
InChIKey
SCIGYBYAZUFDLA-LUVHZPKESA-N
InChI
InChI=1S/C24H28O11/c25-10-14-18(28)19(29)20(30)23(33-14)34-22-16-13(8-9-31-22)17(27)21-24(16,35-21)11-32-15(26)7-6-12-4-2-1-3-5-12/h1-9,13-14,16-23,25,27-30H,10-11H2/b7-6+/t13-,14-,16-,17+,18-,19+,20-,21+,22+,23+,24-/m1/s1
Canonical SMILES
O=C(C=Cc1ccccc1)OCC12OC1C(O)C1C=COC(OC3OC(CO)C(O)C(O)C3O)C12
Isomeric SMILES
C1=CC=C(C=C1)/C=C/C(=O)OC[C@@]23[C@@H]4[C@@H](C=CO[C@H]4O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)[C@@H]([C@@H]2O3)O

Synonyms

  • ACon1_000554
  • beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-(((1-oxo-3-phenyl-2-propenyl)oxy)methyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl

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
492.48 g/molcalc.
Exact mass
492.1632 Dacalc.
LogP (octanol/water)
-1.33calc.
Topological polar surface area
167.7 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
7calc.
Heavy atoms
35calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.54calc.
Formal charge
0calc.
Stereocentres
11calc.
Lipinski rule of five
Passes (1 violation)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=C(C=Cc1ccccc1)OCC12OC1CC1C=COC(OC3CCCCO3)C12

O=C(C=Cc1ccccc1)OCC12OC1CC1C=COC(OC3CCCCO3)C12

5 rings, 29 atoms.

6 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.

Globularin suppliers

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

Frequently asked questions

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

What is Globularin?

Globularin has been reported in Penstemon glaber, Globularia orientalis, and other organisms.

What is the CAS number of Globularin?

The CAS registry number of Globularin is 1399-49-1. Other or deprecated CAS numbers: 58286-51-4.

What is the molecular formula and weight of Globularin?

The molecular formula of Globularin is C24H28O11 and its molar mass is 492.48 g/mol.

Is Globularin hazardous?

No GHS hazard classification for Globularin 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 Globularin?

Globularin 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 Globularin?

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

What is the price of Globularin?

Suppliers quote Globularin 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 Globularin

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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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