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Steroids and sterols

3-Rxgsd

Also known as 3-O-((Rhamnopyranosyl-(1-3)-xylopyranosyl-(1-2)-)(glucopyranosyl-(1-3))-glucopyranosyl-(1-3)-glucopyranosyl)spirostan-2,3-diol

CAS 139979-76-3Formula C56H92O27Molar mass 1,197.33 g/mol
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3-Rxgsd chemical structure, C56H92O27, CAS 139979-76-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
139979-76-3
Formula
C56H92O27
Molar mass
1,197.33 g/mol
HS code
293890
Category
Steroids and sterols

What is 3-Rxgsd?

Plain description, key identifiers and synonyms

3-Rxgsd is a chemical substance with the molecular formula C56H92O27 and a molar mass of 1,197.33 g/mol. Its CAS registry number is 139979-76-3. The IUPAC name is (2R,3R,4S,5S,6S)-6-(hydroxymethyl)-2-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-[(4S,5'R,7S,8R,9S,13S)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxane-3,4,5-triol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R,3R,4S,5S,6S)-6-(hydroxymethyl)-2-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-[(4S,5'R,7S,8R,9S,13S)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxane-3,4,5-triol
CAS number
139979-76-3
Molecular formula
C56H92O27
InChIKey
KADIFLZXWRELEB-VSVOSOTASA-N
InChI
InChI=1S/C56H92O27/c1-20-8-11-55(74-18-20)21(2)34-30(81-55)13-26-24-7-6-23-12-27(28(60)14-54(23,5)25(24)9-10-53(26,34)4)56(48(72)41(68)38(65)32(16-58)82-56)83-52-47(80-51-44(71)40(67)37(64)31(15-57)76-51)46(79-49-42(69)36(63)29(61)19-73-49)45(33(17-59)77-52)78-50-43(70)39(66)35(62)22(3)75-50/h20-52,57-72H,6-19H2,1-5H3/t20-,21+,22+,23?,24?,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+,52-,53+,54+,55?,56-/m1/s1
Canonical SMILES
CC1CCC2(OC1)OC1CC3C4CCC5CC(C6(OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(OC8OCC(O)C(O)C8O)C7OC7OC(CO)C(O)C(O)C7O)OC(CO)C(O)C(O)C6O)C(O)CC5(C)C4CCC3(C)C1C2C
Isomeric SMILES
C[C@@H]1CCC2([C@H]([C@H]3[C@@H](O2)CC4[C@@]3(CCC5C4CCC6[C@@]5(CC(C(C6)[C@]7([C@@H]([C@H]([C@@H]([C@@H](O7)CO)O)O)O)O[C@@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)O[C@@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)C)C)C)OC1

Synonyms

  • 3-O-((Rhamnopyranosyl-(1-3)-xylopyranosyl-(1-2)-)(glucopyranosyl-(1-3))-glucopyranosyl-(1-3)-glucopyranosyl)spirostan-2,3-diol

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
1,197.33 g/molcalc.
Exact mass
1,196.5826 Dacalc.
LogP (octanol/water)
-4.85calc.
Topological polar surface area
425.2 Ųcalc.
Hydrogen bond donors
16calc.
Hydrogen bond acceptors
27calc.
Rotatable bonds
12calc.
Heavy atoms
83calc.
Rings
11calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
37calc.
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, C1CCC(OC2COC(OC3(C4CCC5C(CCC6C5CCC5C7CC8(CCCCO8)OC7CC56)C4)CCCCO3)C(OC3CCCCO3)C2OC2CCCCO2)OC1

C1CCC(OC2COC(OC3(C4CCC5C(CCC6C5CCC5C7CC8(CCCCO8)OC7CC56)C4)CCCCO3)C(OC3CCCCO3)C2OC2CCCCO2)OC1

11 rings, 59 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.

3-Rxgsd suppliers

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3-Rxgsd price

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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 3-Rxgsd 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 3-Rxgsd is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 3-Rxgsd, based on the data on this page

What is 3-Rxgsd?

3-Rxgsd is a chemical substance with the molecular formula C56H92O27 and a molar mass of 1,197.33 g/mol. Its CAS registry number is 139979-76-3.

What is the CAS number of 3-Rxgsd?

The CAS registry number of 3-Rxgsd is 139979-76-3.

What is the molecular formula and weight of 3-Rxgsd?

The molecular formula of 3-Rxgsd is C56H92O27 and its molar mass is 1,197.33 g/mol.

Is 3-Rxgsd hazardous?

No GHS hazard classification for 3-Rxgsd 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 3-Rxgsd?

3-Rxgsd 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 3-Rxgsd?

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What is the price of 3-Rxgsd?

Suppliers quote 3-Rxgsd 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 3-Rxgsd

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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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