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Steroids and sterols

Orb2695067

CAS 913263-86-2Formula C32H44O10Molar mass 588.69 g/mol
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Orb2695067 chemical structure, C32H44O10, CAS 913263-86-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
913263-86-2
Formula
C32H44O10
Molar mass
588.69 g/mol
HS code
293220
Category
Steroids and sterols

What is Orb2695067?

Plain description, key identifiers and synonyms

Plantagiolide C has been reported in Tacca plantaginea.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1S,2S,4S,5R,7S,9S,10R,11S,12S,14S,15R,16R,19S)-10-acetyloxy-5-hydroxy-16-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-11,15-dimethyl-3,8-dioxahexacyclo[10.7.0.02,4.05,11.07,9.015,19]nonadecan-14-yl] acetate
CAS number
913263-86-2
Molecular formula
C32H44O10
InChIKey
JUDIAROJRBXXRT-UJLRICLZSA-N
InChI
InChI=1S/C32H44O10/c1-13-9-21(41-29(36)17(13)12-33)14(2)18-7-8-19-24-20(10-23(30(18,19)5)38-15(3)34)31(6)27(39-16(4)35)25-22(40-25)11-32(31,37)28-26(24)42-28/h14,18-28,33,37H,7-12H2,1-6H3/t14-,18+,19-,20-,21+,22-,23-,24-,25-,26-,27-,28-,30+,31-,32-/m0/s1
Canonical SMILES
CC(=O)OC1CC2C(C3OC3C3(O)CC4OC4C(OC(C)=O)C23C)C2CCC(C(C)C3CC(C)=C(CO)C(=O)O3)C12C
Isomeric SMILES
CC1=C(C(=O)O[C@H](C1)[C@@H](C)[C@H]2CC[C@@H]3[C@@]2([C@H](C[C@H]4[C@H]3[C@H]5[C@H](O5)[C@@]6([C@@]4([C@H]([C@@H]7[C@H](C6)O7)OC(=O)C)C)O)OC(=O)C)C)CO

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
588.69 g/molcalc.
Exact mass
588.2934 Dacalc.
LogP (octanol/water)
2.47calc.
Topological polar surface area
144.4 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
10calc.
Rotatable bonds
5calc.
Heavy atoms
42calc.
Rings
7calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.84calc.
Formal charge
0calc.
Stereocentres
15calc.
Lipinski rule of five
Passes (1 violation)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=C1C=CCC(CC2CCC3C2CCC2C4CC5OC5CC4C4OC4C32)O1

O=C1C=CCC(CC2CCC3C2CCC2C4CC5OC5CC4C4OC4C32)O1

7 rings, 27 atoms.

1 other chemical 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.

Orb2695067 suppliers

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Orb2695067 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 Orb2695067 is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

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

The HS code shown for Orb2695067 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb2695067, based on the data on this page

What is Orb2695067?

Plantagiolide C has been reported in Tacca plantaginea.

What is the CAS number of Orb2695067?

The CAS registry number of Orb2695067 is 913263-86-2.

What is the molecular formula and weight of Orb2695067?

The molecular formula of Orb2695067 is C32H44O10 and its molar mass is 588.69 g/mol.

What is Orb2695067 used for?

Known uses and roles of Orb2695067 include cooling agents in flavors and fragrances.

Is Orb2695067 hazardous?

No GHS hazard classification for Orb2695067 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 Orb2695067?

Orb2695067 is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Orb2695067?

Post a free request on CompoundList and suppliers of Orb2695067 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2695067?

Suppliers quote Orb2695067 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

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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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