Serinsäure - ≥95% , CAS No.55306-03-1

CAS: 55306-03-1 Cat. No.: S329534 Summenformel: C₃₀H₄₈O₆ Molekulargewicht: 504.7 PubChem CID: 124214

GRADE & PURITY ≥95%

Synonyms

Olean-12-en-28-oic acid, 2,3,19,23-tetrahydroxy-, (2alpha,3beta,4beta,19alpha)- | SCHEMBL5799851 | AKOS040763084 | Sericic acid, >=95% (LC/MS-ELSD) | (2alpha,3beta,4beta,19alpha)-2,3,19,23-Tetrahydroxyolean-12-en-28-oic acid | DTXSID40970632 | HB4081 | Se

Storage

Lagerung bei -20°C

Shipped In

Eistruhe + Eispads

Übersicht

Produktanwendung：

Serinsäure ist ein Antioxidans, das als schwacher PDE4A-Hemmer, entzündungshemmend, pilzhemmend und antibakteriell wirkt.

Specifications

Synonyme

Olean-12-en-28-oic acid, 2,3,19,23-tetrahydroxy-, (2alpha,3beta,4beta,19alpha)- | SCHEMBL5799851 | AKOS040763084 | Sericic acid, >=95% (LC/MS-ELSD) | (2alpha,3beta,4beta,19alpha)-2,3,19,23-Tetrahydroxyolean-12-en-28-oic acid | DTXSID40970632 | HB4081 | Se

Spezifikationen & Reinheit

≥95%

Quelle

Vochysia divergens

Storage

Lagerung bei -20°C

Verschickt in

Eistruhe + Eispads

Reinheit

≥95%

Produkteigenschaften

pKa

pKa: 4.42 (Predicted)

Namen und Kennungen

Kanonisches Lächeln

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1O)C)C(=O)O)C

IUPAC Name

(1S,4aR,6aR,6aS,6bR,8aR,9S,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

InChIKey

IFIQVSCCFRXSJV-GOVAGAJPSA-N

INCHI

1S/C30H48O6/c1-25(2)11-13-30(24(35)36)14-12-28(5)17(21(30)23(25)34)7-8-20-26(3)15-18(32)22(33)27(4,16-31)19(26)9-10-29(20,28)6/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21-,22+,23+,26+,27-,28-,29-,30+/m1/s1

Isomere SMILES

C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4[C@@H](C(CC5)(C)C)O)C(=O)O)C)(C[C@H]([C@@H]([C@]3(C)CO)O)O)C

WGK Deutschland

3

PubChem CID

124214

Molekulargewicht

504.7

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Prenol lipids
      • Subclass Triterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Prenol lipids
• Subclass: Triterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Triterpenoids
• Alternative Parents: 12-beta-hydroxysteroids Secondary alcohols Cyclic alcohols and derivatives Polyols Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Triterpenoid - 12-hydroxysteroid - Hydroxysteroid - 12-beta-hydroxysteroid - Steroid - Cyclic alcohol - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Polyol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Alcohol - Primary alcohol - Aliphatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in ethanol, DMSO, DMF, and water (sparingly).
• Brechungsindex: n20D1.59 (Predicted)
• Siedepunkt (°C): ~639.3° C at 760 mmHg (Predicted)
• Schmelzpunkt (°C): 282° C
• Molekulargewicht: 504.700 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 504.345 Da
• Monoisotopic Mass: 504.345 Da
• Topological Polar Surface Area: 118.000 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 974.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 11
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 55306-03-1, the molecular formula is C30H48O6, and the molecular weight is 504.7 g/mol. InChIKey IFIQVSCCFRXSJV-GOVAGAJPSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.