Dolatriol
TL;DR: Dolatriol (CAS 60259-78-1) is a chemical compound with molecular formula C20H32O3 and molecular weight 320.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,5,9a-triol
Also Known As: Dolatriol, DOLABELLA (B712568K039), 5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,5,9a-triol, (3S,5aS,9aS,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo(f)azulene-3,9a-diol, (3S,5R,5aS,9aS,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo(f)azulene-3,5,9a-triol
| Molecular Formula | C20H32O3 |
|---|---|
| Molecular Weight | 320.24 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.23514 |
| Heavy Atoms | 23 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 60259-78-1 |
|---|---|
| SMILES | CC(C)C1(CCC2(C1=CC(C3(CCCC(=C)C3(C2)O)C)O)C)O |
| InChIKey | OZAJHJQSQQYTRD-UHFFFAOYSA-N |
Product Overview
Dolatriol (CAS 60259-78-1), with molecular formula C20H32O3 and molecular weight 320.24 g/mol. IUPAC: 5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,5,9a-triol.
Chemical Property Profile of Dolatriol
Property Insights of Dolatriol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dolatriol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dolatriol. Following Lipinski's Rule of Five, Dolatriol 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 Dolatriol?
The CAS number of Dolatriol is 60259-78-1.
What is the molecular formula of Dolatriol?
The molecular formula of Dolatriol is C20H32O3.
What is the molecular weight of Dolatriol?
The molecular weight of Dolatriol is 320.24 g/mol.
Where can I buy Dolatriol?
You can request a quote for Dolatriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dolatriol?
Yes, KEHONG BIO provides custom synthesis services for Dolatriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.