丹参内酯
TL;DR: 丹参内酯 (CAS 105351-70-0) is a chemical compound with molecular formula C17H12O3 and molecular weight 264.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丹参内酯
6,14-dimethyl-12,16-dioxatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,8,11(15),13-heptaen-17-one
Also Known As: Tanshinlactone, Tanshilactone, VDYMGLBSIBHGCP-UHFFFAOYSA-, 10H-Furo[3,2-b]naphtho[2,1-d]pyran-10-one,1,6-dimethyl-, 6,14-dimethyl-12,16-dioxatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,8,11(15),13-heptaen-17-one
| Molecular Formula | C17H12O3 |
|---|---|
| Molecular Weight | 264.08 g/mol |
| LogP | 4.30924 |
| Topological Polar Surface Area | 43.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.07864 |
| Heavy Atoms | 20 |
| Complexity | 1034.8365 |
Chemical Identifiers
| CAS Number | 105351-70-0 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=CC=C1)C(=O)OC4=C3OC=C4C |
Product Overview
丹参内酯 (CAS 105351-70-0), with molecular formula C17H12O3 and molecular weight 264.08 g/mol. IUPAC: 6,14-dimethyl-12,16-dioxatetracyclo[8.7.0.02,7.011,15]heptadeca-1(10),2,4,6,8,11(15),13-heptaen-17-one.
Chemical Property Profile of 丹参内酯
Property Insights of 丹参内酯
The XLogP value of 4.30924 indicates that 丹参内酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.35 Ų, 丹参内酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丹参内酯 has 0 hydrogen bond donor(s) and 3 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 丹参内酯?
The CAS number of 丹参内酯 is 105351-70-0.
What is the molecular formula of 丹参内酯?
The molecular formula of 丹参内酯 is C17H12O3.
What is the molecular weight of 丹参内酯?
The molecular weight of 丹参内酯 is 264.08 g/mol.
Where can I buy 丹参内酯?
You can request a quote for 丹参内酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丹参内酯?
Yes, KEHONG BIO provides custom synthesis services for 丹参内酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.