Determine the necessary mass, volume, or concentration for preparing a solution.
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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Protected from light,Store at -20°C,Desiccated 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Store at -20°C. Store under desiccating conditions. The product can be stored for up to 12 months.
| Pubchem Sid | 504750588 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750588 |
| Sonrisas canónicas | CC(CC1=C2C3=C(C(=C(C4=C3C5=C6C2=C(C(=O)C=C6OCOC5=CC4=O)C(=C1OC)O)O)OC)CC(C)O)O |
| IUPAC Name | 7,19-dihydroxy-5,21-bis(2-hydroxypropyl)-6,20-dimethoxy-12,14-dioxahexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1,3(8),4,6,10,15,18(23),19,21-nonaene-9,17-dione |
| InChIKey | MXLWQNCWIIZUQT-UHFFFAOYSA-N |
| INCHI | 1S/C29H26O10/c1-10(30)5-12-18-19-13(6-11(2)31)29(37-4)27(35)21-15(33)8-17-23(25(19)21)22-16(38-9-39-17)7-14(32)20(24(18)22)26(34)28(12)36-3/h7-8,10-11,30-31,34-35H,5-6,9H2,1-4H3 |
| Isómeros SMILES | CC(CC1=C2C3=C(C(=C(C4=C3C5=C6C2=C(C(=O)C=C6OCOC5=CC4=O)C(=C1OC)O)O)OC)CC(C)O)O |
| Peso molecular | 534.51 |
| Reaxy-Rn | 1613436 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1613436&ln= |
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 | Benzenoids |
| Clase | Perylenequinones |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Perylenequinones |
| Alternative Parents | Phenanthrols Anthracenes Naphthols and derivatives Anisoles Alkyl aryl ethers Vinylogous esters Vinylogous acids Secondary alcohols Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Perylenequinone - Phenanthrol - Anthracene - Phenanthrene - 2-naphthol - 1-naphthol - Anisole - Alkyl aryl ether - Vinylogous ester - Vinylogous acid - Secondary alcohol - Acetal - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as perylenequinones. These are heterocyclic compounds characterized by two 8-hydroxy-1,4-dihydronaphthalen-1-one moieties joined together one or two CC-bonds. |
| External Descriptors | Not available |
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| Solubilidad | Soluble in ethanol and in DMSO |
|---|---|
| Sensibilidad | Light sensitive |
| Peso molecular | 534.500 g/mol |
| XLogP3 | 4.000 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 6 |
| Exact Mass | 534.153 Da |
| Monoisotopic Mass | 534.153 Da |
| Topological Polar Surface Area | 152.000 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 988.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Jing Yukai, Zhang Yunfei, Wang Xiaocui, Wang Yufen, Hu Ying, Wen Bin, Dai Xin, Duan Xuemei, Li Haonan, Dong Shumin, Yan Ze, Fan Yufeng, Wang Cong-yi, Liu Xiansheng, Zhang Ruiping. (2025) MBD2 promotes B cell differentiation and BCR signaling in systemic lupus erythematosus by regulating the LEF-1-PTEN-PI3K axis. Cell Death & Disease, 16 (1): (1-16). [PMID:40467564] [10.1038/s41419-025-07750-6] |