Spruceanol
TL;DR: Spruceanol (CAS 72963-56-5) is a chemical compound with molecular formula C20H28O2 and molecular weight 300.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4aR,10aS)-8-ethenyl-1,1,4a,7-tetramethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol
Also Known As: Spruceanol, 3alpha,12-Hydroxy-cleistanth-8,11,13,15-tetraene, (2R,4aR,10aS)-8-ethenyl-1,1,4a,7-tetramethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol, (2R,4aR,10aS)-1,1,4a,7-tetramethyl-8-vinyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol, 14-Ethenyl-13-methylpodocarpa-8(14),9(11),12-triene-3,12-diol
| Molecular Formula | C20H28O2 |
|---|---|
| Molecular Weight | 300.21 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.20892 |
| Heavy Atoms | 22 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 72963-56-5 |
|---|---|
| SMILES | CC1=C(C=C2C(=C1C=C)CC[C@H]3[C@]2(CC[C@H](C3(C)C)O)C)O |
| InChIKey | KNSRUHGNXCWGHF-GGPKGHCWSA-N |
Product Overview
Spruceanol (CAS 72963-56-5), with molecular formula C20H28O2 and molecular weight 300.21 g/mol. IUPAC: (2R,4aR,10aS)-8-ethenyl-1,1,4a,7-tetramethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol.
Chemical Property Profile of Spruceanol
Property Insights of Spruceanol
The XLogP value of 5.2 indicates that Spruceanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Spruceanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spruceanol has 2 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 Spruceanol?
The CAS number of Spruceanol is 72963-56-5.
What is the molecular formula of Spruceanol?
The molecular formula of Spruceanol is C20H28O2.
What is the molecular weight of Spruceanol?
The molecular weight of Spruceanol is 300.21 g/mol.
Where can I buy Spruceanol?
You can request a quote for Spruceanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spruceanol?
Yes, KEHONG BIO provides custom synthesis services for Spruceanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.