Ovalicine subst.
TL;DR: Ovalicine subst. (CAS 19683-98-8) is a chemical compound with molecular formula C16H24O5 and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one
Also Known As: Ovalicin, Graphinone, OVALICINE SUBST., (-)-Ovalicin, Antibiotic SL 1846
| Molecular Formula | C16H24O5 |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.16238 |
| Heavy Atoms | 21 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 19683-98-8 |
|---|---|
| SMILES | CC(=CCC1C(O1)(C)C2(C(C(=O)CCC23CO3)OC)O)C |
| InChIKey | NESRXFGQJARQNM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ovalicine subst. (CAS 19683-98-8), with molecular formula C16H24O5 and molecular weight 296.16 g/mol. IUPAC: 4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one.
Chemical Property Profile of Ovalicine subst.
Property Insights of Ovalicine subst.
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ovalicine subst.. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ovalicine subst.. Following Lipinski's Rule of Five, Ovalicine subst. has 1 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 Ovalicine subst.?
The CAS number of Ovalicine subst. is 19683-98-8.
What is the molecular formula of Ovalicine subst.?
The molecular formula of Ovalicine subst. is C16H24O5.
What is the molecular weight of Ovalicine subst.?
The molecular weight of Ovalicine subst. is 296.16 g/mol.
Where can I buy Ovalicine subst.?
You can request a quote for Ovalicine subst. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ovalicine subst.?
Yes, KEHONG BIO provides custom synthesis services for Ovalicine subst. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.