Elasnin - ≥97% , CAS No.68112-21-0

CAS: 68112-21-0 Cat. No.: E337445 Molecular Weight: 392.57
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
3,5-Dibutyl-4-hydroxy-6-(6-oxoundecan-5-yl)-2H-pyran-2-one | 3,5-dibutyl-2-hydroxy-6-(6-oxoundecan-5-yl)-4h-pyran-4-one | BRN 1265379 | 3,5-Dibutyl-6-(1-butyl-2-oxoheptyl)-4-hydroxy-2H-pyran-2-one | CHEMBL54524
Storage
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
E337445-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$659.90
5mg
E337445-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,945.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Elasnin is an inhibitor of human leukocyte elastase (IC|50|=1.3μg/ml), different other elastases, and chymotrypsin (IC|50|=82μg/ml).

Specifications

Synonyms
3, 5-Dibutyl-4-hydroxy-6-(6-oxoundecan-5-yl)-2H-pyran-2-one | 3, 5-dibutyl-2-hydroxy-6-(6-oxoundecan-5-yl)-4h-pyran-4-one | BRN 1265379 | 3, 5-Dibutyl-6-(1-butyl-2-oxoheptyl)-4-hydroxy-2H-pyran-2-one | CHEMBL54524
Specifications & Purity
≥97%
Storage
Protected from light, Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Purity
≥97%
Names and Identifiers
Canonical SmilesCCCCCC(=O)C(CCCC)C1=C(C(=C(C(=O)O1)CCCC)O)CCCC
IUPAC Name3,5-dibutyl-4-hydroxy-6-(6-oxoundecan-5-yl)pyran-2-one
InChIKeySNSPVFCYLPZTRZ-UHFFFAOYSA-N
INCHI1S/C24H40O4/c1-5-9-13-17-21(25)18(14-10-6-2)23-19(15-11-7-3)22(26)20(16-12-8-4)24(27)28-23/h18,26H,5-17H2,1-4H3
Isomeric SMILES CCCCCC(=O)C(CCCC)C1=C(C(=C(C(=O)O1)CCCC)O)CCCC
Molecular Weight 392.57
Reaxy-Rn 1265379
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1265379&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyrans
SubclassPyranones and derivatives
Intermediate Tree Nodes Not available
Direct ParentPyranones and derivatives
Alternative Parents Vinylogous acids  Heteroaromatic compounds  Lactones  Ketones  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Pyranone - Heteroaromatic compound - Vinylogous acid - Lactone - Ketone - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyranones and derivatives. These are compounds containing a pyran ring which bears a ketone.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
CELA1 Tchem Elastase 1 (40 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ELANE Tclin Leukocyte elastase (8173 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CTRC Tchem Chymotrypsin C (381 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeDateItem
H2408541Certificate of AnalysisAug 01, 2024 E337445
Chemical and Physical Properties
SolubilitySoluble in DMSO (5mg/ml), methanol (5mg/ml) or methylene chloride
SensitivityLight sensitive
Molecular Weight392.600 g/mol
XLogP37.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count15
Exact Mass392.293 Da
Monoisotopic Mass392.293 Da
Topological Polar Surface Area63.600 Ų
Heavy Atom Count28
Formal Charge0
Complexity571.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.