Rubusoside
Also known as Kaur-16-en-18-oic acid, 13-(beta-D-glucopyranosyloxy)-, beta-D-glucopyranosyl ester, (4alpha)-, 1-O-[(8alpha,9beta,10alpha,13alpha)-13-(beta-D-glucopyranosyloxy)-18-oxokaur-16-en-18-yl]-beta-D-glucopyranose, Rubusoside?
Key facts
What buyers check first
- CAS number
- 64849-39-4
- Formula
- C32H50O13
- Molar mass
- 642.74 g/mol
- HS code
- 293890
- Category
- Humectants
What is Rubusoside?
Plain description, key identifiers and synonyms
Rubusoside is a steviol glycoside that is steviol in which both the carboxy group and the tertiary allylic hydroxy group have been converted to their corresponding beta-D-glucosides. A precious bioactive natural sweetener which mainly exists the in Chinese sweet tea plant, Rubus suavissimus. It has a role as a sweetening agent and a plant metabolite. It is a steviol glycoside, a beta-D-glucoside, a bridged compound and a tetracyclic diterpenoid. It is functionally related to a steviol.
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,10R,13S)-5,9-dimethyl-14-methylidene-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
- CAS number
- 64849-39-4 CAS number cross-checked
- Molecular formula
- C32H50O13
- UNII
- TCV5K3M3GX
- MDL number
- MFCD06799426
- INCI name
- RUBUSOSIDE
- InChIKey
- YWPVROCHNBYFTP-OSHKXICASA-N
- InChI
- InChI=1S/C32H50O13/c1-15-11-31-9-5-18-29(2,7-4-8-30(18,3)28(41)44-26-24(39)22(37)20(35)16(12-33)42-26)19(31)6-10-32(15,14-31)45-27-25(40)23(38)21(36)17(13-34)43-27/h16-27,33-40H,1,4-14H2,2-3H3/t16-,17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,29-,30-,31-,32+/m1/s1
- Canonical SMILES
- C=C1CC23CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)CCCC4(C)C2CCC1(OC1OC(CO)C(O)C(O)C1O)C3
- Isomeric SMILES
- C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@](C3)(C(=C)C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)(C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O
Synonyms
- Kaur-16-en-18-oic acid, 13-(beta-D-glucopyranosyloxy)-, beta-D-glucopyranosyl ester, (4alpha)-
- 1-O-[(8alpha,9beta,10alpha,13alpha)-13-(beta-D-glucopyranosyloxy)-18-oxokaur-16-en-18-yl]-beta-D-glucopyranose
- Rubusoside?
- Kaur-16-en-18-oic acid, 13-(ss-D-glucopyranosyloxy)-, ss-D-glucopyranosyl ester, (4a)-, 1H-2,10a-Ethanophenanthrene, kaur-16-en-18-oic acid deriv., Rubusoside
- Rubusoside (Standard)
- (4| cent)-13-(|?-D-Glucopyranosyloxy)kaur-16-en-18-oic acid |?-D-glucopyranosyl ester
- 1-o-[(5|A,9|A,10|A,13|A)-13-(|A-d-glucopyranosyloxy)-18-oxokaur-16-en-18-yl]-|A-d-glucopyranose
- 1-O-[13alpha-(beta-D-glucopyranosyloxy)-18-oxo-5beta,8alpha,9beta,10alpha-kaur-16-en-18-yl]-beta-D-glucopyranose
- Kaur-16-en-18-oic acid, 13-(beta-d-glucopyranosyloxy)-, beta-d-glucopyranosyl ester, (4.alpha.)-
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 | 642.74 g/molcalc.Computed value |
|---|---|
| Exact mass | 642.3251 Dacalc.Computed value |
| LogP (octanol/water) | -0.76calc.Computed value |
| Topological polar surface area | 215.8 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 8calc.Computed value |
| Hydrogen bond acceptors | 13calc.Computed value |
| Rotatable bonds | 6calc.Computed value |
| Heavy atoms | 45calc.Computed value |
| Rings | 6calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.91calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 16calc.Computed value |
| Lipinski rule of five | Fails (3 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
C=C1CC23CCC4C(C(=O)OC5CCCCO5)CCCC4C2CCC1(OC1CCCCO1)C3
6 rings, 33 atoms.
No other chemical in our database has 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.
Rubusoside suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- China, Chengdu ManufacturerUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
- China, ChangshaUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
- China, ChengduUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
- United States, ShirleyUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
- China, ChangshaUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
- China, ShanghaiUnclaimed profileRubusosideGrade, purity and minimum order on requestPrice on request
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
6 suppliers in 2 countries
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Rubusoside 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
Industries and functions
Cosmetic ingredient, INCI name RUBUSOSIDE(humectant, skin conditioning)
Roles
- additive
- eukaryotic metabolite
- flavouring agent
- food additive
- food component
- metabolite
- physiological role
- plant metabolite
- sweetening agent
Functional uses
- Humectant
- Softener and conditioner
Cosmetic functions
- Humectant
- Skin conditioning
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- EU cosmetic ingredient inventory
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Rubusoside is traded under.
Natural or reproduced by synthesis, other than rutoside (rutin) and its derivatives
- United States22.3%
- India * partner reported7.8%
- Brazil5.5%
* Partner reported figures, a lower bound.
The HS code shown for Rubusoside is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Rubusoside, based on the data on this page
What is Rubusoside?
What is the CAS number of Rubusoside?
What is the molecular formula and weight of Rubusoside?
What is Rubusoside used for?
Is Rubusoside hazardous?
What is the HS code of Rubusoside?
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What is the price of Rubusoside?
Guides for buyers
Practical guides that help when you source, ship or handle Rubusoside
- Article, FormulationHow to choose a cosmetic emulsifierA structured way to choose an emulsifier for creams and lotions: emulsion type, HLB and its limits, emulsifier families, formula fit, stability testing and what to ask suppliers.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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