3-Hydroxysclareol
TL;DR: 3-Hydroxysclareol (CAS 15440-38-7) is a chemical compound with molecular formula C20H36O3 and molecular weight 324.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,4aR,6S,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,6-diol
Also Known As: 3-Hydroxysclareol, 3EC-hydroxysclareol, 3beta-Hydroxysclareol, KST-1A1687, labda-14-en-3EC,8I<<,13EC-triol
| Molecular Formula | C20H36O3 |
|---|---|
| Molecular Weight | 324.27 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.26645 |
| Heavy Atoms | 23 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 15440-38-7 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C([C@@H]1CC[C@@]([C@@H]2CC[C@](C)(C=C)O)(C)O)(C)C)O |
| InChIKey | GHXNUBMJNAHZRP-CJEFFJQMSA-N |
Product Overview
3-Hydroxysclareol (CAS 15440-38-7), with molecular formula C20H36O3 and molecular weight 324.27 g/mol. IUPAC: (1R,2R,4aR,6S,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,6-diol.
Chemical Property Profile of 3-Hydroxysclareol
Property Insights of 3-Hydroxysclareol
The XLogP value of 3.4 indicates that 3-Hydroxysclareol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxysclareol. Following Lipinski's Rule of Five, 3-Hydroxysclareol has 3 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 3-Hydroxysclareol?
The CAS number of 3-Hydroxysclareol is 15440-38-7.
What is the molecular formula of 3-Hydroxysclareol?
The molecular formula of 3-Hydroxysclareol is C20H36O3.
What is the molecular weight of 3-Hydroxysclareol?
The molecular weight of 3-Hydroxysclareol is 324.27 g/mol.
Where can I buy 3-Hydroxysclareol?
You can request a quote for 3-Hydroxysclareol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxysclareol?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxysclareol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.