≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Yadanziolide A, isolated from the cultivated dry seeds of Brucea javanica , has strong antiviral activities with IC 50 of 5.5 μM against tobacco mosaic virus. Yadanziolide A shows significant antitumor effects
Form:Solid
IC50& Target:IC50: 5.5 μM (Tobacco mosaic virus)
| Sonrisas canónicas | CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(C4(C(C(=O)O3)O)O)(OC5)CO)O)O)C)O |
|---|---|
| IUPAC Name | (1R,2R,3R,6R,8S,12S,13S,14R,15R,16S,17R)-2,3,12,15,16-pentahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-ene-4,11-dione |
| InChIKey | QXKKRGMRXXMDDP-JVDXBALSSA-N |
| INCHI | 1S/C20H26O10/c1-7-3-9(22)13(24)17(2)8(7)4-10-18-6-29-19(5-21,14(25)11(23)12(17)18)20(18,28)15(26)16(27)30-10/h3,8,10-15,21,23-26,28H,4-6H2,1-2H3/t8-,10+,11+,12+,13+,14-,15-,17-,18+,19+,20-/m0/s1 |
| Isómeros SMILES | CC1=CC(=O)[C@H]([C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H]([C@]([C@@]4([C@H](C(=O)O3)O)O)(OC5)CO)O)O)C)O |
| PubChem CID | 10320238 |
| Peso molecular | 426.41 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Clase | Prenol lipids |
| Subclass | Terpene lactones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Quassinoids |
| Alternative Parents | Triterpenoids Naphthopyrans Naphthalenes Furopyrans Delta valerolactones Oxepanes Cyclohexenones Pyrans Oxanes Tetrahydrofurans Tertiary alcohols Furans Secondary alcohols Carboxylic acid esters Cyclic alcohols and derivatives Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Hydrocarbon derivatives Organic oxides Primary alcohols |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Substituents | Polycyclic triterpenoid - Triterpenoid - C-20 quassinoid skeleton - Quassinoid - Naphthopyran - Naphthalene - Furopyran - Delta valerolactone - Cyclohexenone - Delta_valerolactone - Oxepane - Oxane - Pyran - Cyclic alcohol - Furan - Tetrahydrofuran - Tertiary alcohol - Secondary alcohol - Cyclic ketone - Lactone - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Polyol - Dialkyl ether - Ether - Carbonyl group - Organic oxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as quassinoids. These are a group of compounds chemically degraded from triterpenes. According to their basic skeleton, quassinoids are categorized into five distinct groups, C-18, C-19, C-20, C-22 and C-25 types. The C-20 quassinoids can be further classified into two types, tetracyclic and the pentacyclic. The tetracyclic variety does not have oxygenation at C-20, while the pentacyclic quassinoids possess additional oxygenation at C-20 that allows for the formation of an additional ring. |
| External Descriptors | Not available |
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| Solubilidad | DMSO : 100 mg/mL (234.52 mM; Need ultrasonic) |
|---|---|
| Peso molecular | 426.400 g/mol |
| XLogP3 | -2.900 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 1 |
| Exact Mass | 426.153 Da |
| Monoisotopic Mass | 426.153 Da |
| Topological Polar Surface Area | 174.000 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 872.000 |
| 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 |
