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Glycosides and other natural products

Zingibroside R1

Also known as 28-Deglucosylchikusetsusaponin V, 3beta-[(2-O-beta-D-Glucopyranosyl-beta-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oic acid, 3|A-[(2-O-|A-D-Glucopyranosyl-|A-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oic acid

CAS 80930-74-1Formula C42H66O14Molar mass 794.98 g/mol
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Zingibroside R1 chemical structure, C42H66O14, CAS 80930-74-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
80930-74-1
Formula
C42H66O14
Molar mass
794.98 g/mol
HS code
293890
Category
Glycosides and other natural products

What is Zingibroside R1?

Plain description, key identifiers and synonyms

Zingibroside R1 has been reported in Panax japonicus, Meryta lanceolata, and Polyscias fruticosa.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-carboxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid
CAS number
80930-74-1
Molecular formula
C42H66O14
MDL number
MFCD32201173
InChIKey
WJQOMUVKRDJBGZ-COUNGWPASA-N
InChI
InChI=1S/C42H66O14/c1-37(2)14-16-42(36(51)52)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-32(29(47)28(46)31(55-35)33(49)50)56-34-30(48)27(45)26(44)22(19-43)53-34/h8,21-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)/t21-,22+,23-,24+,25-,26+,27-,28-,29-,30+,31-,32+,34-,35+,39-,40+,41+,42-/m0/s1
Canonical SMILES
CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Isomeric SMILES
C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O

Synonyms

  • 28-Deglucosylchikusetsusaponin V
  • 3beta-[(2-O-beta-D-Glucopyranosyl-beta-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oic acid
  • 3|A-[(2-O-|A-D-Glucopyranosyl-|A-D-glucopyranuronosyl)oxy]oleana-12-ene-28-oic acid

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
794.98 g/molcalc.
Exact mass
794.4453 Dacalc.
LogP (octanol/water)
2.97calc.
Topological polar surface area
232.9 Ųcalc.
Hydrogen bond donors
8calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
7calc.
Heavy atoms
56calc.
Rings
7calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.91calc.
Formal charge
0calc.
Stereocentres
18calc.
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, C1=C2C3CCCCC3CCC2C2CCC3CC(OC4OCCCC4OC4CCCCO4)CCC3C2C1

C1=C2C3CCCCC3CCC2C2CCC3CC(OC4OCCCC4OC4CCCCO4)CCC3C2C1

7 rings, 36 atoms.

42 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.

Zingibroside R1 suppliers

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All 2 suppliers

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

2 suppliers in 1 country

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Zingibroside R1 price

Indicative price range per kg from live supplier offers

No published prices right now

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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 Zingibroside R1 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 Zingibroside R1 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Zingibroside R1, based on the data on this page

What is Zingibroside R1?

Zingibroside R1 has been reported in Panax japonicus, Meryta lanceolata, and Polyscias fruticosa.

What is the CAS number of Zingibroside R1?

The CAS registry number of Zingibroside R1 is 80930-74-1.

What is the molecular formula and weight of Zingibroside R1?

The molecular formula of Zingibroside R1 is C42H66O14 and its molar mass is 794.98 g/mol.

Is Zingibroside R1 hazardous?

No GHS hazard classification for Zingibroside R1 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 Zingibroside R1?

Zingibroside R1 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 Zingibroside R1?

CompoundList lists 2 suppliers of Zingibroside R1 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 Zingibroside R1?

Suppliers quote Zingibroside R1 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 Zingibroside R1

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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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