Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-
TL;DR: Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- (CAS 77663-54-8) is a chemical compound with molecular formula C12H20O4 and molecular weight 228.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6S,12R)-5,6-dihydroxy-12-methyl-1-oxacyclododec-3-en-2-one
Also Known As: Cladospolide A, (-)-Cladospolide A, Oxacyclododec-3-en-2-one,5,6-dihydroxy-12- methyl-,(3E,5R,6S,12R)-, Oxacyclododec-3-en-2-one, 5,6-dihydroxy-12-methyl-, (3E,5R,6S,12R)-
| Molecular Formula | C12H20O4 |
|---|---|
| Molecular Weight | 228.14 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.13615 |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 77663-54-8 |
|---|---|
| SMILES | C[C@@H]1CCCCC[C@@H]([C@@H](C=CC(=O)O1)O)O |
| InChIKey | PLHJPQNLCWFPFY-OUAUKWLOSA-N |
Product Overview
Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- (CAS 77663-54-8), with molecular formula C12H20O4 and molecular weight 228.14 g/mol. IUPAC: (5R,6S,12R)-5,6-dihydroxy-12-methyl-1-oxacyclododec-3-en-2-one.
Chemical Property Profile of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-
Property Insights of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-. Following Lipinski's Rule of Five, Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- has 2 hydrogen bond donor(s) and 4 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 Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-?
The CAS number of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- is 77663-54-8.
What is the molecular formula of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-?
The molecular formula of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- is C12H20O4.
What is the molecular weight of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-?
The molecular weight of Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- is 228.14 g/mol.
Where can I buy Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-?
You can request a quote for Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)-?
Yes, KEHONG BIO provides custom synthesis services for Oxacyclododec-3-en-2-one,5,6-dihydroxy-12-methyl-,(3E,5R,6S,12R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.