羟基丹参酮IIA
TL;DR: 羟基丹参酮IIA (CAS 18887-18-8) is a chemical compound with molecular formula C19H18O4 and molecular weight 310.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟基丹参酮IIA
9-hydroxy-1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione
Also Known As: Hydroxytanshinone IIA, Hydroxytanshinone, Hydroxytanshinone II, 3alpha-Hydroxytanshinone IIA, HY-N7177
| Molecular Formula | C19H18O4 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 3.73882 |
| Topological Polar Surface Area | 67.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 310.1205 |
| Heavy Atoms | 23 |
| Complexity | 869.73505 |
Chemical Identifiers
| CAS Number | 18887-18-8 |
|---|---|
| SMILES | CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3C(CCC4(C)C)O |
Product Overview
羟基丹参酮IIA (CAS 18887-18-8), with molecular formula C19H18O4 and molecular weight 310.12 g/mol. IUPAC: 9-hydroxy-1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione.
Chemical Property Profile of 羟基丹参酮IIA
Property Insights of 羟基丹参酮IIA
The XLogP value of 3.73882 indicates that 羟基丹参酮IIA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟基丹参酮IIA. Following Lipinski's Rule of Five, 羟基丹参酮IIA has 1 hydrogen bond donor(s) and 4 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 羟基丹参酮IIA?
The CAS number of 羟基丹参酮IIA is 18887-18-8.
What is the molecular formula of 羟基丹参酮IIA?
The molecular formula of 羟基丹参酮IIA is C19H18O4.
What is the molecular weight of 羟基丹参酮IIA?
The molecular weight of 羟基丹参酮IIA is 310.12 g/mol.
Where can I buy 羟基丹参酮IIA?
You can request a quote for 羟基丹参酮IIA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟基丹参酮IIA?
Yes, KEHONG BIO provides custom synthesis services for 羟基丹参酮IIA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.