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Flavonoids and polyphenols

Sarmenoside III

CAS 947409-91-8Formula C42H46O23Molar mass 918.81 g/mol
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Sarmenoside III chemical structure, C42H46O23, CAS 947409-91-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
947409-91-8
Formula
C42H46O23
Molar mass
918.81 g/mol
HS code
293890
Category
Flavonoids and polyphenols

What is Sarmenoside III?

Plain description, key identifiers and synonyms

Sarmenoside III has been reported in Sedum sarmentosum.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(2R,3S,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
CAS number
947409-91-8
Molecular formula
C42H46O23
InChIKey
MEQZSNYKOKZIGH-XTYPXWDISA-N
InChI
InChI=1S/C42H46O23/c1-14-28(49)32(53)35(56)40(59-14)61-18-11-23(47)27-24(12-18)62-37(17-5-7-20(44)22(46)10-17)38(31(27)52)64-42-39(34(55)29(50)15(2)60-42)65-41-36(57)33(54)30(51)25(63-41)13-58-26(48)8-4-16-3-6-19(43)21(45)9-16/h3-12,14-15,25,28-30,32-36,39-47,49-51,53-57H,13H2,1-2H3/b8-4+/t14-,15-,25+,28-,29-,30+,32+,33-,34+,35+,36+,39+,40-,41-,42-/m0/s1
Canonical SMILES
CC1OC(Oc2cc(O)c3c(=O)c(OC4OC(C)C(O)C(O)C4OC4OC(COC(=O)C=Cc5ccc(O)c(O)c5)C(O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc3c2)C(O)C(O)C1O
Isomeric SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O[C@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)C)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)COC(=O)/C=C/C6=CC(=C(C=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O)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
918.81 g/molcalc.
Exact mass
918.243 Dacalc.
LogP (octanol/water)
-1.51calc.
Topological polar surface area
374.9 Ųcalc.
Hydrogen bond donors
13calc.
Hydrogen bond acceptors
23calc.
Rotatable bonds
11calc.
Heavy atoms
65calc.
Rings
7calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.43calc.
Formal charge
0calc.
Stereocentres
15calc.
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, O=C(C=Cc1ccccc1)OCC1CCCC(OC2CCCOC2Oc2c(-c3ccccc3)oc3cc(OC4CCCCO4)ccc3c2=O)O1

O=C(C=Cc1ccccc1)OCC1CCCC(OC2CCCOC2Oc2c(-c3ccccc3)oc3cc(OC4CCCCO4)ccc3c2=O)O1

7 rings, 50 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.

Sarmenoside III suppliers

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

Frequently asked questions

Quick answers about Sarmenoside III, based on the data on this page

What is Sarmenoside III?

Sarmenoside III has been reported in Sedum sarmentosum.

What is the CAS number of Sarmenoside III?

The CAS registry number of Sarmenoside III is 947409-91-8.

What is the molecular formula and weight of Sarmenoside III?

The molecular formula of Sarmenoside III is C42H46O23 and its molar mass is 918.81 g/mol.

Is Sarmenoside III hazardous?

No GHS hazard classification for Sarmenoside III 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 Sarmenoside III?

Sarmenoside III 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 Sarmenoside III?

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

What is the price of Sarmenoside III?

Suppliers quote Sarmenoside III 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 Sarmenoside III

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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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