Anthemidin
TL;DR: Anthemidin (CAS 71013-34-8) is a chemical compound with molecular formula C15H20O2 and molecular weight 232.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,3aR,4aS,8aS,9aR)-3,5,8a-trimethyl-3,3a,4,4a,9,9a-hexahydrobenzo[f][1]benzofuran-2-one
Also Known As: Anthemidin, Chrysophanol dimethyl ether, Naphtho(2,3-b)furan-2(3H)-one, 3a,4,4a,8a,9,9a-hexahydro-3,5,8a-trimethyl-, (3S-(3alpha,3abeta,4abeta,8aalpha,9abeta))-, (3S,3aR,4aS,8aS,9aR)-3,5,8a-trimethyl-3,3a,4,4a,9,9a-hexahydrobenzo[f][1]benzofuran-2-one, (3S,3aR,4aS,8aS,9aR)-3,5,8a-trimethyl-3,3a,4,4a,9,9a-hexahydrobenzo(f)(1)benzofuran-2-one
| Molecular Formula | C15H20O2 |
|---|---|
| Molecular Weight | 232.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.14633 |
| Heavy Atoms | 17 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 71013-34-8 |
|---|---|
| SMILES | C[C@H]1[C@H]2C[C@H]3C(=CC=C[C@@]3(C[C@H]2OC1=O)C)C |
| InChIKey | BMCOUTUQAWFTFQ-GGAZOKNXSA-N |
Product Overview
Anthemidin (CAS 71013-34-8), with molecular formula C15H20O2 and molecular weight 232.15 g/mol. IUPAC: (3S,3aR,4aS,8aS,9aR)-3,5,8a-trimethyl-3,3a,4,4a,9,9a-hexahydrobenzo[f][1]benzofuran-2-one.
Chemical Property Profile of Anthemidin
Property Insights of Anthemidin
The XLogP value of 3.2 indicates that Anthemidin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Anthemidin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anthemidin has 0 hydrogen bond donor(s) and 2 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 Anthemidin?
The CAS number of Anthemidin is 71013-34-8.
What is the molecular formula of Anthemidin?
The molecular formula of Anthemidin is C15H20O2.
What is the molecular weight of Anthemidin?
The molecular weight of Anthemidin is 232.15 g/mol.
Where can I buy Anthemidin?
You can request a quote for Anthemidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthemidin?
Yes, KEHONG BIO provides custom synthesis services for Anthemidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.