龙口花醌
TL;DR: 龙口花醌 (CAS 21887-01-4) is a chemical compound with molecular formula C20H26O2 and molecular weight 298.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
龙口花醌
6-hydroxy-1,1,4a-trimethyl-7-propan-2-yl-3,4-dihydro-2H-phenanthren-9-one
Also Known As: 5-dehydrosugiol, 5,6-dehydrosugiol, SUGIOL,5-DEHYDRO, Sugiol, .DELTA.5-dehydro-, 12-hydroxyabieta-5,8(14),9(11),12-tetraen-7-one
| Molecular Formula | C20H26O2 |
|---|---|
| Molecular Weight | 298.19 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.19327 |
| Heavy Atoms | 22 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 21887-01-4 |
|---|---|
| SMILES | CC(C)C1=C(C=C2C(=C1)C(=O)C=C3C2(CCCC3(C)C)C)O |
| InChIKey | HUMGJQLBBAYPNM-UHFFFAOYSA-N |
Product Overview
龙口花醌 (CAS 21887-01-4), with molecular formula C20H26O2 and molecular weight 298.19 g/mol. IUPAC: 6-hydroxy-1,1,4a-trimethyl-7-propan-2-yl-3,4-dihydro-2H-phenanthren-9-one.
Chemical Property Profile of 龙口花醌
Property Insights of 龙口花醌
The XLogP value of 5.4 indicates that 龙口花醌 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 龙口花醌 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 龙口花醌 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 龙口花醌?
The CAS number of 龙口花醌 is 21887-01-4.
What is the molecular formula of 龙口花醌?
The molecular formula of 龙口花醌 is C20H26O2.
What is the molecular weight of 龙口花醌?
The molecular weight of 龙口花醌 is 298.19 g/mol.
Where can I buy 龙口花醌?
You can request a quote for 龙口花醌 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 龙口花醌?
Yes, KEHONG BIO provides custom synthesis services for 龙口花醌 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.