Anthriscusin
TL;DR: Anthriscusin (CAS 67008-16-6) is a chemical compound with molecular formula C21H24O7 and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enyl 2-(2-methylbut-2-enoyloxymethyl)but-2-enoate
Also Known As: Anthriscusin, (2E)-3-(7-methoxy-2H-1,3-benzodioxol-5-yl)prop-2-en-1-yl (2Z)-2-({[(2Z)-2-methylbut-2-enoyl]oxy}methyl)but-2-enoate, (Z)-2-Methyl-2-butenoic acid (Z)-2-[[3-(7-methoxy-1,3-benzodioxole-5-yl)-2-propenyloxy]carbonyl]-2-butenyl ester
| Molecular Formula | C21H24O7 |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 388.1522 |
| Heavy Atoms | 28 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 67008-16-6 |
|---|---|
| SMILES | CC=C(C)C(=O)OCC(=CC)C(=O)OCC=CC1=CC2=C(C(=C1)OC)OCO2 |
| InChIKey | FHPUFLKSIYHWOR-UHFFFAOYSA-N |
Product Overview
Anthriscusin (CAS 67008-16-6), with molecular formula C21H24O7 and molecular weight 388.15 g/mol. IUPAC: 3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enyl 2-(2-methylbut-2-enoyloxymethyl)but-2-enoate.
Chemical Property Profile of Anthriscusin
Property Insights of Anthriscusin
The XLogP value of 3.8 indicates that Anthriscusin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Anthriscusin. Following Lipinski's Rule of Five, Anthriscusin 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 Anthriscusin?
The CAS number of Anthriscusin is 67008-16-6.
What is the molecular formula of Anthriscusin?
The molecular formula of Anthriscusin is C21H24O7.
What is the molecular weight of Anthriscusin?
The molecular weight of Anthriscusin is 388.15 g/mol.
Where can I buy Anthriscusin?
You can request a quote for Anthriscusin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthriscusin?
Yes, KEHONG BIO provides custom synthesis services for Anthriscusin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.