Botrydial, dihydro-
TL;DR: Botrydial, dihydro- (CAS 54433-86-2) is a chemical compound with molecular formula C17H28O5 and molecular weight 312.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7,12-dihydroxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.04,12]dodecan-11-yl) acetate
Also Known As: Dihydrobotrydial, Botrydial, dihydro-, 10-syn-Dihydrobotrydial, 1,8b-Dihydroxy-3a,5,5,8-tetramethyldecahydro-1H-indeno[1,7-cd]pyran-6-yl acetate, 8bH-Cyclopenta[de]-2-benzopyran-1,6,8b-triol, decahydro-3a,5,5,8-tetramethyl-, 6-acetate, [1S-(1.alpha.,3a.beta.,5a.alpha.,6.alpha.,8.alpha.,8a.alpha.,8b.alpha.)]-
| Molecular Formula | C17H28O5 |
|---|---|
| Molecular Weight | 312.19 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.19366 |
| Heavy Atoms | 22 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 54433-86-2 |
|---|---|
| SMILES | CC1CC(C2C(CC3(C2(C1C(OC3)O)O)C)(C)C)OC(=O)C |
| InChIKey | QUGYVDURDBEQRB-UHFFFAOYSA-N |
Product Overview
Botrydial, dihydro- (CAS 54433-86-2), with molecular formula C17H28O5 and molecular weight 312.19 g/mol. IUPAC: (7,12-dihydroxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.04,12]dodecan-11-yl) acetate.
Chemical Property Profile of Botrydial, dihydro-
Property Insights of Botrydial, dihydro-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Botrydial, dihydro-. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Botrydial, dihydro-. Following Lipinski's Rule of Five, Botrydial, dihydro- has 2 hydrogen bond donor(s) and 5 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 Botrydial, dihydro-?
The CAS number of Botrydial, dihydro- is 54433-86-2.
What is the molecular formula of Botrydial, dihydro-?
The molecular formula of Botrydial, dihydro- is C17H28O5.
What is the molecular weight of Botrydial, dihydro-?
The molecular weight of Botrydial, dihydro- is 312.19 g/mol.
Where can I buy Botrydial, dihydro-?
You can request a quote for Botrydial, dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Botrydial, dihydro-?
Yes, KEHONG BIO provides custom synthesis services for Botrydial, dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.