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Screening compounds

Paniculoside I

CAS 60129-63-7Formula C26H40O8Molar mass 480.60 g/mol
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Paniculoside I chemical structure, C26H40O8, CAS 60129-63-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
60129-63-7
Formula
C26H40O8
Molar mass
480.60 g/mol
HS code
293299
Category
Screening compounds

What is Paniculoside I?

Plain description, key identifiers and synonyms

(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (1R,4S,5R,9S,10S,13R,15R)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylate has been reported in Stevia ovata.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1R,4S,5R,9S,10S,13R,15R)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
CAS number
60129-63-7
Molecular formula
C26H40O8
InChIKey
RSQGPCRWQCUQBR-HLTNFVLASA-N
InChI
InChI=1S/C26H40O8/c1-13-14-5-6-17-24(2)8-4-9-25(3,16(24)7-10-26(17,11-14)21(13)31)23(32)34-22-20(30)19(29)18(28)15(12-27)33-22/h14-22,27-31H,1,4-12H2,2-3H3/t14-,15-,16+,17+,18-,19+,20-,21-,22+,24-,25-,26-/m1/s1
Canonical SMILES
C=C1C2CCC3C4(C)CCCC(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C4CCC3(C2)C1O
Isomeric SMILES
C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@H](C3)C(=C)[C@H]4O)(C)C(=O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O

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
480.60 g/molcalc.
Exact mass
480.2723 Dacalc.
LogP (octanol/water)
1.27calc.
Topological polar surface area
136.7 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
3calc.
Heavy atoms
34calc.
Rings
5calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.89calc.
Formal charge
0calc.
Stereocentres
12calc.
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=C1CC23CCC4C(C(=O)OC5CCCCO5)CCCC4C2CCC1C3

C=C1CC23CCC4C(C(=O)OC5CCCCO5)CCCC4C2CCC1C3

5 rings, 26 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.

Paniculoside I suppliers

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

Frequently asked questions

Quick answers about Paniculoside I, based on the data on this page

What is Paniculoside I?

(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (1R,4S,5R,9S,10S,13R,15R)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylate has been reported in Stevia ovata.

What is the CAS number of Paniculoside I?

The CAS registry number of Paniculoside I is 60129-63-7.

What is the molecular formula and weight of Paniculoside I?

The molecular formula of Paniculoside I is C26H40O8 and its molar mass is 480.60 g/mol.

What is Paniculoside I used for?

Known uses and roles of Paniculoside I include tackifiers in adhesives and sealants, building blocks in research and laboratory and screening compounds in research and laboratory.

Is Paniculoside I hazardous?

No GHS hazard classification for Paniculoside I 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 Paniculoside I?

Paniculoside I 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 Paniculoside I?

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

What is the price of Paniculoside I?

Suppliers quote Paniculoside I 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 Paniculoside I

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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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