Protodioscin
Also known as (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl alpha-L-rhamnopyranosyl-(1->2)-[alpha-L-rhamnopyranosyl-(1->4)]-beta-D-glucopyranoside, (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl alpha-L-rhamnopyranosyl-(1->2)-(alpha-L-rhamnopyranosyl-(1->4))-beta-D-glucopyranoside, Furostanol I
Key facts
What buyers check first
- CAS number
- 55056-80-9
- Formula
- C51H84O22
- Molar mass
- 1,049.21 g/mol
- EC number
- 866-818-2
- HS code
- 293890
- Category
- Glycosides and other natural products
What is Protodioscin?
Plain description, key identifiers and synonyms
Protodioscin is a furostanol glycoside that consists of the trisaccharide alpha-L-Rha-(14)-[alpha-L-Rha-(12)]-beta-D-Glc attached to position 3 of 26-(beta-D-glucopyranosyloxy)-3beta,22-dihydroxyfurost-5-ene via a glycosidic linkage. Found in several plant species including yams, asparagus and funugreek. It has a role as an antineoplastic agent, an antilipemic drug, a neuroprotective agent, an anti-inflammatory agent, an apoptosis inducer and a plant metabolite. It is a beta-D-glucoside, a pentacyclic triterpenoid, a cyclic hemiketal, a steroid saponin and a trisaccharide derivative. It derives from a hydride of a furostan.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[[(1S,2S,4S,6R,7S,8R,9S,12S,13R,16S)-6-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-16-yl]oxy]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
- CAS number
- 55056-80-9 CAS number cross-checkedOther or deprecated CAS: 90288-44-1
- EC number
- 866-818-2
- Molecular formula
- C51H84O22
- UNII
- D0LC3PH24P
- MDL number
- MFCD03427682
- INCI name
- PROTODIOSCIN
- InChIKey
- LVTJOONKWUXEFR-UEZXSUPNSA-N
- InChI
- InChI=1S/C51H84O22/c1-20(19-65-45-39(60)38(59)35(56)30(17-52)69-45)9-14-51(64)21(2)32-29(73-51)16-28-26-8-7-24-15-25(10-12-49(24,5)27(26)11-13-50(28,32)6)68-48-44(72-47-41(62)37(58)34(55)23(4)67-47)42(63)43(31(18-53)70-48)71-46-40(61)36(57)33(54)22(3)66-46/h7,20-23,25-48,52-64H,8-19H2,1-6H3/t20-,21+,22+,23+,25+,26-,27+,28+,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39-,40-,41-,42+,43-,44-,45-,46+,47+,48-,49+,50+,51-/m1/s1
- Canonical SMILES
- CC(CCC1(O)OC2CC3C4CC=C5CC(OC6OC(CO)C(OC7OC(C)C(O)C(O)C7O)C(O)C6OC6OC(C)C(O)C(O)C6O)CCC5(C)C4CCC3(C)C2C1C)COC1OC(CO)C(O)C(O)C1O
- Isomeric SMILES
- C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@@H]([C@H]([C@@H](O7)C)O)O)O)O)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)C)C)O[C@@]1(CC[C@@H](C)CO[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O
Synonyms
- (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl alpha-L-rhamnopyranosyl-(1->2)-[alpha-L-rhamnopyranosyl-(1->4)]-beta-D-glucopyranoside
- (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl alpha-L-rhamnopyranosyl-(1->2)-(alpha-L-rhamnopyranosyl-(1->4))-beta-D-glucopyranoside
- Furostanol I
- Protodioscin?
- Protodioscine
- Furostane base-2H + O-Hex, O-Hex-dHex-dHex
- proto-dioscin
- Protodioscin (Standard)
- Furost-5-ene-3,22,26-triol 3-chacotrioside-26-glucopyranoside
- (3b, 25R)-26-(b-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl O-6-deoxy-a-L-mannopyranosyl-(1-2)-O-[6-deoxy-a-L-mannopyranosyl-(1- 4)]-b-D-glucopyranoside
- (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl alpha-L-rhamnopyranosyl-(1->2)-[alpha
- 3beta,22alpha,26-trihydroxyfurost-5-ene 3-o-beta-chacotrioside 26-o-beta-d-glucopyranoside
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 | 1,049.21 g/molcalc.Computed value |
|---|---|
| Exact mass | 1,048.5454 Dacalc.Computed value |
| LogP (octanol/water) | -1.98calc.Computed value |
| Topological polar surface area | 346.1 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 13calc.Computed value |
| Hydrogen bond acceptors | 22calc.Computed value |
| Rotatable bonds | 14calc.Computed value |
| Heavy atoms | 73calc.Computed value |
| Rings | 9calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.96calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 31calc.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
C1=C2CC(OC3OCC(OC4CCCCO4)CC3OC3CCCCO3)CCC2C2CCC3C4CC(CCCCOC5CCCCO5)OC4CC3C2C1
9 rings, 52 atoms.
7 other chemicals share this scaffoldSafety 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.
Protodioscin suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- China, ChangshaUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- China, Chengdu ManufacturerUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- India, Ahmedabad ManufacturerUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- China, Hefei ManufacturerUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- China, NanjingUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- China, ChengduUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- Price on request
- India ManufacturerUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- China, Xi'an ManufacturerUnclaimed profileProtodioscinGrade, purity and minimum order on requestPrice on request
- United StatesUnclaimed profileProtodioscinGrade, 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
16 suppliers in 3 countries
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Protodioscin 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 PROTODIOSCIN(skin conditioning)
Roles
- anti-inflammatory agent
- antilipemic drug
- antineoplastic agent
- apoptosis inducer
- eukaryotic metabolite
- metabolite
- neuroprotective agent
- pharmaceutical
- plant metabolite
- protective agent
Functional uses
- Softener and conditioner
Cosmetic functions
- 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 Protodioscin 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 Protodioscin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Protodioscin, based on the data on this page
What is Protodioscin?
What is the CAS number of Protodioscin?
What is the molecular formula and weight of Protodioscin?
What is Protodioscin used for?
Is Protodioscin hazardous?
What is the HS code of Protodioscin?
Where can I buy Protodioscin?
Where can I buy Protodioscin in India?
What is the price of Protodioscin?
Guides for buyers
Practical guides that help when you source, ship or handle Protodioscin
- 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
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
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