Anomalin
TL;DR: Anomalin (CAS 4970-26-7) is a chemical compound with molecular formula C24H26O7 and molecular weight 426.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(9R,10R)-8,8-dimethyl-9-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] (E)-2-methylbut-2-enoate
Also Known As: Anomalin, (-)-Praeruptorin B, J3.229.911C, ((9R,10R)-8,8-Dimethyl-9-((E)-2-Methylbut-2-Enoyl)Oxy-2-Oxo-9,10-Dihydropyrano(2,3-F)Chromen-10-Yl) (E)-2-Methylbut-2-Enoate, (9R)-2-Oxo-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b ]dipyran-9alpha,10alpha-diol 9,10-bis[(E)-2-methyl-2-butenoate]
| Molecular Formula | C24H26O7 |
|---|---|
| Molecular Weight | 426.17 g/mol |
| LogP | 4.3925 |
| Topological Polar Surface Area | 92.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.16785 |
| Heavy Atoms | 31 |
| Complexity | 1150.2173 |
Chemical Identifiers
| CAS Number | 4970-26-7 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@H]1[C@H](C(OC2=C1C3=C(C=C2)C=CC(=O)O3)(C)C)OC(=O)/C(=C/C)/C |
Product Overview
Anomalin (CAS 4970-26-7), with molecular formula C24H26O7 and molecular weight 426.17 g/mol. IUPAC: [(9R,10R)-8,8-dimethyl-9-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of Anomalin
Property Insights of Anomalin
The XLogP value of 4.3925 indicates that Anomalin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Anomalin. Following Lipinski's Rule of Five, Anomalin has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Anomalin?
The CAS number of Anomalin is 4970-26-7.
What is the molecular formula of Anomalin?
The molecular formula of Anomalin is C24H26O7.
What is the molecular weight of Anomalin?
The molecular weight of Anomalin is 426.17 g/mol.
Where can I buy Anomalin?
You can request a quote for Anomalin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anomalin?
Yes, KEHONG BIO provides custom synthesis services for Anomalin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.