Mesuaxanthone A , CAS No.3561-81-7

CAS: 3561-81-7 Cat. No.: M668898 分子式: C14H10O5 分子量: 258.23 PubChem CID: 5281651
注文可能
Synonyms
Mesuaxanthone A | 1,5-Dihydroxy-3-methoxyxanthone | 9H-Xanthen-9-one, 1,5-dihydroxy-3-methoxy- | 1,5-Dihydroxy-3-methoxy-9H-xanthen-9-one | 1,5-dihydroxy-3-methoxyxanthen-9-one | 1,5-Dihydroxy-3-methoxy-xanthen-9-one | CHEBI:6785 | C10081 | MesuaxanthoneA
Storage
Room temperature
★
Size
USA
ドイツ (EU)*
Price
Qty
1mg
M668898-1mg
受注生産 · 8~12週間

$571.90

$857.90
保存 $286.00 (33.34%)
5mg
M668898-5mg
受注生産 · 8~12週間

$1,999.90

$2,999.90
保存 $1,000.00 (33.33%)
Enter a quantity for the sizes you want to add.
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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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

同義語
Mesuaxanthone A | 1,5-Dihydroxy-3-methoxyxanthone | 9H-Xanthen-9-one, 1,5-dihydroxy-3-methoxy- | 1,5-Dihydroxy-3-methoxy-9H-xanthen-9-one | 1,5-dihydroxy-3-methoxyxanthen-9-one | 1,5-Dihydroxy-3-methoxy-xanthen-9-one | CHEBI:6785 | C10081 | MesuaxanthoneA
保管条件
Room temperature
製品の性質
ALogP
2.8
名前と識別子
カノニカル・スマイル
COC1=CC(=C2C(=C1)OC3=C(C2=O)C=CC=C3O)O
IUPAC Name
1,5-dihydroxy-3-methoxyxanthen-9-one
InChIKey
IQIGECASJMDDMD-UHFFFAOYSA-N
INCHI
1S/C14H10O5/c1-18-7-5-10(16)12-11(6-7)19-14-8(13(12)17)3-2-4-9(14)15/h2-6,15-16H,1H3
異性体SMILES
COC1=CC(=C2C(=C1)OC3=C(C2=O)C=CC=C3O)O
PubChem CID
5281651
分子量
258.23

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
分類Benzopyrans
Subclass1-benzopyrans
Intermediate Tree Nodes Dibenzopyrans - Xanthenes
Direct ParentXanthones
Alternative Parents Chromones  Anisoles  Pyranones and derivatives  Alkyl aryl ethers  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Vinylogous acids  Heteroaromatic compounds  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Xanthone - Chromone - Anisole - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous acid - Ether - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
説明This compound belongs to the class of organic compounds known as xanthones. These are polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.
External Descriptors xanthenes
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)
MAOA Tclin Amine oxidase [flavin-containing] A (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
MAOA Tclin Monoamine oxidase A (11911 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MAOB Tclin Monoamine oxidase B (8835 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
分子量258.230 g/mol
XLogP32.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass258.053 Da
Monoisotopic Mass258.053 Da
Topological Polar Surface Area76.000 Ų
Heavy Atom Count19
Formal Charge0
Complexity358.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
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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