Phellamurin - ≥96% , CAS No.52589-11-4

CAS: 52589-11-4 Cat. No.: P696259 分子式: C26H30O11 分子量: 518.51 PubChem CID: 193876
注文可能
GRADE & PURITY ≥96%
Storage
Room temperature
★
Size
USA
ドイツ (EU)*
Price
Qty
5mg
P696259-5mg
受注生産 · 8~12週間
$1,074.90
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Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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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.

Specifications

仕様と純度
≥96%
保管条件
Room temperature
純度
≥96%
名前と識別子
カノニカル・スマイルCC(=CCC1=C(C=C(C2=C1OC(C(C2=O)O)C3=CC=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O)C
IUPAC Name(2R,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
InChIKeyGRDZTDZJQRPNCN-YIANMRPHSA-N
INCHI1S/C26H30O11/c1-11(2)3-8-14-16(35-26-23(34)21(32)19(30)17(10-27)36-26)9-15(29)18-20(31)22(33)24(37-25(14)18)12-4-6-13(28)7-5-12/h3-7,9,17,19,21-24,26-30,32-34H,8,10H2,1-2H3/t17-,19-,21+,22+,23-,24-,26-/m1/s1
異性体SMILES CC(=CCC1=C(C=C(C2=C1O[C@@H]([C@H](C2=O)O)C3=CC=C(C=C3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C
PubChem CID 193876
分子量 518.51

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
SuperclassPhenylpropanoids and polyketides
分類Flavonoids
SubclassFlavonoid glycosides
Intermediate Tree Nodes Flavonoid O-glycosides
Direct ParentFlavonoid-7-O-glycosides
Alternative Parents 8-prenylated flavanones  3-hydroxyflavonoids  4'-hydroxyflavonoids  5-hydroxyflavonoids  Flavanonols  Phenolic glycosides  Hexoses  O-glycosyl compounds  Chromones  Aryl alkyl ketones  1-hydroxy-2-unsubstituted benzenoids  Alkyl aryl ethers  Oxanes  Benzene and substituted derivatives  Vinylogous acids  Secondary alcohols  Oxacyclic compounds  Acetals  Polyols  Organic oxides  Primary alcohols  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Flavonoid-7-o-glycoside - 8-prenylated flavanone - 8-prenylated flavan - Hydroxyflavonoid - 3-hydroxyflavonoid - 4'-hydroxyflavonoid - Flavanonol - 5-hydroxyflavonoid - Flavanone - Flavan - Phenolic glycoside - Hexose monosaccharide - Chromone - Glycosyl compound - O-glycosyl compound - Benzopyran - Chromane - 1-benzopyran - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Oxane - Monosaccharide - Vinylogous acid - Secondary alcohol - Ketone - Polyol - Ether - Organoheterocyclic compound - Oxacycle - Acetal - Primary alcohol - Organic oxide - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
説明This compound belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position.
External Descriptors Dihyroflavonols
3 D構造
インタラクティブ化学構造モデル





関連ターゲット(人間)
XDH Tclin Xanthine dehydrogenase (1038 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
化学的性質と物理的性質
引火点(°F)Not applicable
引火点(°C)Not applicable
分子量518.500 g/mol
XLogP32.000
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass518.179 Da
Monoisotopic Mass518.179 Da
Topological Polar Surface Area186.000 Ų
Heavy Atom Count37
Formal Charge0
Complexity808.000
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
ソリューション計算機
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