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Screening compounds

Delsoline

Also known as Acomonine, Aconitane-1,7,8-triol, 20-ethyl-6,14,16-trimethoxy-4-(methoxymethyl)-, (1alpha,6beta,14alpha,16beta)-, (1S,2R,3R,4S,5R,6S,8R,9S,13S,16S,17R,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo(7.7.2.12,5.01,10.03,8.013,17)nonadecane-8,9,16-triol

CAS 509-18-2Formula C25H41NO7Molar mass 467.60 g/mol
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Delsoline chemical structure, C25H41NO7, CAS 509-18-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
509-18-2
Formula
C25H41NO7
Molar mass
467.60 g/mol
HS code
293399
Category
Screening compounds

What is Delsoline?

Plain description, key identifiers and synonyms

Delsoline is a chemical substance with the molecular formula C25H41NO7 and a molar mass of 467.60 g/mol. Its CAS registry number is 509-18-2. The IUPAC name is (1S,4S,5R,6S,8R,9S,10S,13S,16S,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,4S,5R,6S,8R,9S,10S,13S,16S,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol
CAS number
509-18-2 CAS number cross-checked
Molecular formula
C25H41NO7
UNII
8NCS5NCP4W
InChIKey
JVBLTQQBEQQLEV-LPHVGPHASA-N
InChI
InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18+,19?,20+,21+,22+,23-,24+,25-/m1/s1
Canonical SMILES
CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14
Isomeric SMILES
CCN1C[C@@]2(CC[C@@H]([C@]34[C@H]1[C@]([C@H](C23)OC)([C@]5(C[C@@H]([C@H]6CC4C5[C@H]6OC)OC)O)O)O)COC

Synonyms

  • Acomonine
  • Aconitane-1,7,8-triol, 20-ethyl-6,14,16-trimethoxy-4-(methoxymethyl)-, (1alpha,6beta,14alpha,16beta)-
  • (1S,2R,3R,4S,5R,6S,8R,9S,13S,16S,17R,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo(7.7.2.12,5.01,10.03,8.013,17)nonadecane-8,9,16-triol
  • (1alpha,5xi,6beta,9xi,10xi,14alpha)-20-ethyl-6,14,16-trimethoxy-4-(methoxymethyl)aconitane-1,7,8-triol
  • 18-o-Methylgigactonine
  • Aconitane-1,7,8-triol, 20-ethyl-4-(methoxymethyl)-6,14,16-trimethoxy-, (1-alpha,6-beta,14-alpha,16-beta)-

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
467.60 g/molcalc.
Exact mass
467.2883 Dacalc.
LogP (octanol/water)
0.27calc.
Topological polar surface area
100.9 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
6calc.
Heavy atoms
33calc.
Rings
6calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
13calc.
Lipinski rule of five
Passes (0 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, C1CC2CNC3C4CC2C3(C1)C1CC2CCC4C1C2

C1CC2CNC3C4CC2C3(C1)C1CC2CCC4C1C2

6 rings, 19 atoms.

124 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.

Delsoline suppliers

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Delsoline 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 Delsoline is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Delsoline?

Delsoline is a chemical substance with the molecular formula C25H41NO7 and a molar mass of 467.60 g/mol. Its CAS registry number is 509-18-2. The IUPAC name is (1S,4S,5R,6S,8R,9S,10S,13S,16S,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol.

What is the CAS number of Delsoline?

The CAS registry number of Delsoline is 509-18-2.

What is the molecular formula and weight of Delsoline?

The molecular formula of Delsoline is C25H41NO7 and its molar mass is 467.60 g/mol.

What is Delsoline used for?

Known uses and roles of Delsoline include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Delsoline hazardous?

No GHS hazard classification for Delsoline 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 Delsoline?

Delsoline is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Delsoline?

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

What is the price of Delsoline?

Suppliers quote Delsoline 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 Delsoline

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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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