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Screening compounds

Oleanolic acid benzoate

Also known as (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-benzoyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

CAS 6153-31-7Formula C37H52O4Molar mass 560.82 g/mol
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Oleanolic acid benzoate chemical structure, C37H52O4, CAS 6153-31-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
6153-31-7
Formula
C37H52O4
Molar mass
560.82 g/mol
HS code
291819
Category
Screening compounds

What is Oleanolic acid benzoate?

Plain description, key identifiers and synonyms

Oleanolic acid benzoate is a chemical substance with the molecular formula C37H52O4 and a molar mass of 560.82 g/mol. Its CAS registry number is 6153-31-7. The IUPAC name is (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-benzoyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-benzoyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
CAS number
6153-31-7
Molecular formula
C37H52O4
InChIKey
AFUJWZAKNFIQGK-RRLKWQEHSA-N
InChI
InChI=1S/C37H52O4/c1-32(2)19-21-37(31(39)40)22-20-35(6)25(26(37)23-32)13-14-28-34(5)17-16-29(41-30(38)24-11-9-8-10-12-24)33(3,4)27(34)15-18-36(28,35)7/h8-13,26-29H,14-23H2,1-7H3,(H,39,40)/t26-,27-,28+,29-,34-,35+,36+,37-/m0/s1
Canonical SMILES
CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC(=O)c6ccccc6)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)OC(=O)C6=CC=CC=C6

Synonyms

  • (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-benzoyloxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic 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
560.82 g/molcalc.
Exact mass
560.3866 Dacalc.
LogP (octanol/water)
9.1calc.
Topological polar surface area
63.6 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
3calc.
Heavy atoms
41calc.
Rings
6calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.73calc.
Formal charge
0calc.
Stereocentres
8calc.
Lipinski rule of five
Fails (2 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(OC1CCC2C(CCC3C4CCC5CCCCC5C4=CCC23)C1)c1ccccc1

O=C(OC1CCC2C(CCC3C4CCC5CCCCC5C4=CCC23)C1)c1ccccc1

6 rings, 31 atoms.

5 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.

Oleanolic acid benzoate suppliers

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Oleanolic acid benzoate 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

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 Oleanolic acid benzoate is traded under.

HS 2918.19Indicative HS code

Carboxylic acids with alcohol function but without other oxygen function, their…

World exports in 2024
$1.37B
+0.5% vs 2023, imports $1.18B
2019 to 2024
Top exporters
  1. China23.7%
  2. Italy14.7%
  3. India * partner reported12.0%
Top importers
  1. Germany11.7%
  2. South Korea9.8%
  3. Italy9.6%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Oleanolic acid benzoate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Oleanolic acid benzoate, based on the data on this page

What is Oleanolic acid benzoate?

Oleanolic acid benzoate is a chemical substance with the molecular formula C37H52O4 and a molar mass of 560.82 g/mol. Its CAS registry number is 6153-31-7.

What is the CAS number of Oleanolic acid benzoate?

The CAS registry number of Oleanolic acid benzoate is 6153-31-7.

What is the molecular formula and weight of Oleanolic acid benzoate?

The molecular formula of Oleanolic acid benzoate is C37H52O4 and its molar mass is 560.82 g/mol.

What is Oleanolic acid benzoate used for?

Known uses and roles of Oleanolic acid benzoate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Oleanolic acid benzoate hazardous?

No GHS hazard classification for Oleanolic acid benzoate 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 Oleanolic acid benzoate?

Oleanolic acid benzoate is usually classified under HS code 291819 (Carboxylic acids with alcohol function but without other oxygen function, their…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Oleanolic acid benzoate?

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

What is the price of Oleanolic acid benzoate?

Suppliers quote Oleanolic acid benzoate 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 Oleanolic acid benzoate

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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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